data_nef_c19755_2mk6 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2MK6 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 GLU middle . . 3 A 3 ILE middle . . 4 A 4 GLU middle . . 5 A 5 ARG middle . . 6 A 6 ILE middle . . 7 A 7 ASN middle . . 8 A 8 GLU middle . . 9 A 9 HIS middle . . 10 A 10 THR middle . . 11 A 11 VAL middle . . 12 A 12 LYS middle . . 13 A 13 PHE middle . . 14 A 14 TYR middle . . 15 A 15 MET middle . . 16 A 16 SER middle . . 17 A 17 TYR middle . . 18 A 18 GLY middle . false 19 A 19 ASP middle . . 20 A 20 ILE middle . . 21 A 21 GLU middle . . 22 A 22 ASP middle . . 23 A 23 ARG middle . . 24 A 24 GLY middle . false 25 A 25 PHE middle . . 26 A 26 ASP middle . . 27 A 27 ARG middle . . 28 A 28 GLU middle . . 29 A 29 GLU middle . . 30 A 30 ILE middle . . 31 A 31 TRP middle . . 32 A 32 TYR middle . . 33 A 33 ASN middle . . 34 A 34 ARG middle . . 35 A 35 GLU middle . . 36 A 36 ARG middle . . 37 A 37 SER middle . . 38 A 38 GLU middle . . 39 A 39 GLU middle . . 40 A 40 LEU middle . . 41 A 41 PHE middle . . 42 A 42 TRP middle . . 43 A 43 GLU middle . . 44 A 44 VAL middle . . 45 A 45 MET middle . . 46 A 46 ASP middle . . 47 A 47 GLU middle . . 48 A 48 VAL middle . . 49 A 49 HIS middle . . 50 A 50 GLU middle . . 51 A 51 GLU middle . . 52 A 52 GLU middle . . 53 A 53 GLU middle . . 54 A 54 PHE middle . . 55 A 55 ALA middle . . 56 A 56 VAL middle . . 57 A 57 GLU middle . . 58 A 58 GLY middle . false 59 A 59 PRO middle . false 60 A 60 LEU middle . . 61 A 61 TRP middle . . 62 A 62 ILE middle . . 63 A 63 GLN middle . . 64 A 64 VAL middle . . 65 A 65 GLN middle . . 66 A 66 ALA middle . . 67 A 67 LEU middle . . 68 A 68 ASP middle . . 69 A 69 LYS middle . . 70 A 70 GLY middle . false 71 A 71 LEU middle . . 72 A 72 GLU middle . . 73 A 73 ILE middle . . 74 A 74 ILE middle . . 75 A 75 VAL middle . . 76 A 76 THR middle . . 77 A 77 LYS middle . . 78 A 78 ALA middle . . 79 A 79 GLN middle . . 80 A 80 LEU middle . . 81 A 81 SER middle . . 82 A 82 LYS middle . . 83 A 83 ASP middle . . 84 A 84 LEU middle . . 85 A 85 ASP middle . . 86 A 86 LYS middle . . 87 A 87 LEU middle . . 88 A 88 VAL middle . . 89 A 89 PRO middle . false 90 A 90 ARG end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 MET HA H 1 4.368 0.000 A 1 MET HBx H 1 2.031 0.006 A 1 MET HBy H 1 2.099 0.008 A 1 MET HE% H 1 1.889 0.006 A 1 MET HGx H 1 2.309 0.001 A 1 MET HGy H 1 2.435 0.018 A 1 MET CA C 13 55.192 0.088 A 1 MET CB C 13 33.795 0.123 A 1 MET CE C 13 17.478 0.047 A 1 MET CG C 13 31.213 0.036 A 2 GLU H H 1 8.571 0.018 A 2 GLU HA H 1 4.681 0.002 A 2 GLU HBx H 1 1.983 0.003 A 2 GLU HBy H 1 2.098 0.007 A 2 GLU HGx H 1 2.263 0.003 A 2 GLU C C 13 174.704 0.064 A 2 GLU CA C 13 55.866 0.073 A 2 GLU CB C 13 32.406 0.053 A 2 GLU CG C 13 36.335 0.041 A 2 GLU N N 15 123.952 0.048 A 3 ILE H H 1 8.565 0.004 A 3 ILE HA H 1 4.712 0.004 A 3 ILE HB H 1 1.658 0.014 A 3 ILE HD1% H 1 0.603 0.004 A 3 ILE HG1x H 1 0.839 0.015 A 3 ILE HG1y H 1 1.317 0.004 A 3 ILE HG2% H 1 0.633 0.006 A 3 ILE C C 13 174.736 0.000 A 3 ILE CA C 13 60.277 0.146 A 3 ILE CB C 13 40.861 0.104 A 3 ILE CD1 C 13 14.147 0.033 A 3 ILE CG1 C 13 27.825 0.087 A 3 ILE CG2 C 13 17.598 0.048 A 3 ILE N N 15 121.558 0.041 A 4 GLU H H 1 9.153 0.008 A 4 GLU HA H 1 4.561 0.007 A 4 GLU HBx H 1 1.868 0.003 A 4 GLU HBy H 1 1.926 0.004 A 4 GLU HGy H 1 2.158 0.005 A 4 GLU HGx H 1 1.927 0.003 A 4 GLU C C 13 174.708 0.067 A 4 GLU CA C 13 55.228 0.058 A 4 GLU CB C 13 33.009 0.037 A 4 GLU CG C 13 36.205 0.036 A 4 GLU N N 15 126.319 0.068 A 5 ARG H H 1 9.002 0.003 A 5 ARG HA H 1 4.560 0.003 A 5 ARG HBx H 1 1.703 0.002 A 5 ARG HBy H 1 1.960 0.016 A 5 ARG HDy H 1 3.289 0.003 A 5 ARG HDx H 1 3.051 0.002 A 5 ARG HGx H 1 1.526 0.001 A 5 ARG HGy H 1 1.561 0.003 A 5 ARG C C 13 175.807 0.109 A 5 ARG CA C 13 55.123 0.082 A 5 ARG CB C 13 29.653 0.040 A 5 ARG CD C 13 43.565 0.085 A 5 ARG CG C 13 27.571 0.031 A 5 ARG N N 15 127.727 0.040 A 6 ILE H H 1 8.030 0.005 A 6 ILE HA H 1 3.904 0.002 A 6 ILE HB H 1 1.488 0.005 A 6 ILE HD1% H 1 0.683 0.005 A 6 ILE HG1y H 1 1.318 0.005 A 6 ILE HG1x H 1 1.181 0.008 A 6 ILE HG2% H 1 0.863 0.004 A 6 ILE C C 13 176.468 0.059 A 6 ILE CA C 13 62.971 0.066 A 6 ILE CB C 13 38.162 0.076 A 6 ILE CD1 C 13 12.050 0.014 A 6 ILE CG1 C 13 27.903 0.052 A 6 ILE CG2 C 13 16.942 0.042 A 6 ILE N N 15 129.149 0.048 A 7 ASN H H 1 8.147 0.005 A 7 ASN HA H 1 4.559 0.010 A 7 ASN HBy H 1 3.298 0.003 A 7 ASN HBx H 1 3.167 0.005 A 7 ASN HD2y H 1 7.846 0.005 A 7 ASN HD2x H 1 6.802 0.005 A 7 ASN C C 13 175.254 0.000 A 7 ASN CA C 13 52.853 0.086 A 7 ASN CB C 13 38.275 0.101 A 7 ASN N N 15 112.808 0.070 A 7 ASN ND2 N 15 114.944 0.036 A 8 GLU H H 1 8.770 0.011 A 8 GLU HA H 1 4.050 0.004 A 8 GLU HBx H 1 1.734 0.008 A 8 GLU HBy H 1 1.894 0.005 A 8 GLU HGy H 1 2.028 0.001 A 8 GLU HGx H 1 1.962 0.005 A 8 GLU C C 13 176.486 0.019 A 8 GLU CA C 13 59.802 0.085 A 8 GLU CB C 13 29.451 0.081 A 8 GLU CG C 13 35.857 0.025 A 8 GLU N N 15 121.087 0.083 A 9 HIS H H 1 7.921 0.008 A 9 HIS HA H 1 4.965 0.004 A 9 HIS HBx H 1 3.111 0.004 A 9 HIS HBy H 1 3.334 0.004 A 9 HIS HD2 H 1 6.905 0.005 A 9 HIS HE1 H 1 7.675 0.003 A 9 HIS CA C 13 55.805 0.150 A 9 HIS CB C 13 32.984 0.073 A 9 HIS CD2 C 13 119.578 0.085 A 9 HIS CE1 C 13 138.727 0.087 A 9 HIS N N 15 113.719 0.032 A 10 THR H H 1 7.349 0.004 A 10 THR HA H 1 5.736 0.004 A 10 THR HB H 1 3.547 0.004 A 10 THR HG2% H 1 1.051 0.004 A 10 THR C C 13 173.396 0.003 A 10 THR CA C 13 62.820 0.115 A 10 THR CB C 13 71.465 0.044 A 10 THR CG2 C 13 21.439 0.030 A 10 THR N N 15 116.218 0.038 A 11 VAL H H 1 9.043 0.004 A 11 VAL HA H 1 4.857 0.000 A 11 VAL HB H 1 1.723 0.009 A 11 VAL HGx% H 1 0.576 0.009 A 11 VAL HGy% H 1 0.695 0.014 A 11 VAL C C 13 172.156 0.026 A 11 VAL CA C 13 59.876 0.045 A 11 VAL CB C 13 35.986 0.076 A 11 VAL CGx C 13 20.748 0.055 A 11 VAL CGy C 13 21.754 0.109 A 11 VAL N N 15 124.880 0.062 A 12 LYS H H 1 8.884 0.005 A 12 LYS HA H 1 5.584 0.011 A 12 LYS HBy H 1 1.647 0.007 A 12 LYS HBx H 1 1.507 0.005 A 12 LYS HDx H 1 1.471 0.004 A 12 LYS HDy H 1 1.507 0.002 A 12 LYS HEx H 1 2.674 0.003 A 12 LYS HEy H 1 2.768 0.002 A 12 LYS HGx H 1 1.154 0.004 A 12 LYS HGy H 1 1.209 0.005 A 12 LYS C C 13 173.380 0.000 A 12 LYS CA C 13 54.205 0.091 A 12 LYS CB C 13 37.457 0.093 A 12 LYS CD C 13 29.894 0.048 A 12 LYS CE C 13 42.003 0.048 A 12 LYS CG C 13 24.771 0.042 A 12 LYS N N 15 124.164 0.029 A 13 PHE H H 1 8.989 0.004 A 13 PHE HA H 1 5.328 0.002 A 13 PHE HBx H 1 3.037 0.008 A 13 PHE HBy H 1 3.080 0.001 A 13 PHE HDx H 1 6.847 0.004 A 13 PHE HDy H 1 6.847 0.004 A 13 PHE HEx H 1 6.954 0.003 A 13 PHE HEy H 1 6.954 0.003 A 13 PHE HZ H 1 6.804 0.004 A 13 PHE C C 13 172.237 0.053 A 13 PHE CA C 13 55.986 0.074 A 13 PHE CB C 13 41.916 0.051 A 13 PHE CDx C 13 132.248 0.073 A 13 PHE CDy C 13 132.248 0.073 A 13 PHE CEx C 13 130.587 0.051 A 13 PHE CEy C 13 130.587 0.051 A 13 PHE CZ C 13 128.588 0.031 A 13 PHE N N 15 124.228 0.040 A 14 TYR H H 1 8.670 0.010 A 14 TYR HA H 1 5.387 0.005 A 14 TYR HBx H 1 2.651 0.005 A 14 TYR HBy H 1 3.033 0.003 A 14 TYR HDx H 1 6.759 0.003 A 14 TYR HDy H 1 6.759 0.003 A 14 TYR HEx H 1 6.417 0.004 A 14 TYR HEy H 1 6.417 0.004 A 14 TYR C C 13 174.713 0.003 A 14 TYR CA C 13 55.953 0.070 A 14 TYR CB C 13 41.508 0.052 A 14 TYR CDx C 13 133.373 0.037 A 14 TYR CDy C 13 133.373 0.037 A 14 TYR CEx C 13 117.350 0.102 A 14 TYR CEy C 13 117.350 0.102 A 14 TYR N N 15 121.263 0.030 A 15 MET H H 1 7.927 0.011 A 15 MET HA H 1 4.417 0.003 A 15 MET HBx H 1 1.647 0.005 A 15 MET HBy H 1 1.800 0.009 A 15 MET HE% H 1 1.814 0.003 A 15 MET HGy H 1 2.546 0.007 A 15 MET HGx H 1 2.398 0.004 A 15 MET C C 13 173.614 0.000 A 15 MET CA C 13 54.305 0.121 A 15 MET CB C 13 37.439 0.104 A 15 MET CE C 13 17.539 0.106 A 15 MET CG C 13 33.112 0.064 A 15 MET N N 15 124.869 0.043 A 16 SER H H 1 9.061 0.003 A 16 SER HA H 1 4.396 0.004 A 16 SER HBx H 1 4.059 0.005 A 16 SER HBy H 1 4.338 0.010 A 16 SER C C 13 175.508 0.014 A 16 SER CA C 13 57.637 0.123 A 16 SER CB C 13 65.033 0.054 A 16 SER N N 15 120.626 0.057 A 17 TYR H H 1 8.411 0.003 A 17 TYR HA H 1 4.360 0.003 A 17 TYR HBx H 1 2.802 0.008 A 17 TYR HBy H 1 3.126 0.006 A 17 TYR HDx H 1 6.954 0.003 A 17 TYR HDy H 1 6.954 0.003 A 17 TYR HEx H 1 6.714 0.003 A 17 TYR HEy H 1 6.714 0.003 A 17 TYR C C 13 178.684 0.006 A 17 TYR CA C 13 61.956 0.051 A 17 TYR CB C 13 36.989 0.060 A 17 TYR CDx C 13 131.743 0.086 A 17 TYR CDy C 13 131.743 0.086 A 17 TYR CEx C 13 119.097 0.066 A 17 TYR CEy C 13 119.097 0.066 A 17 TYR N N 15 119.917 0.036 A 18 GLY H H 1 8.534 0.007 A 18 GLY HAx H 1 3.903 0.005 A 18 GLY C C 13 175.454 0.025 A 18 GLY CA C 13 47.446 0.040 A 18 GLY N N 15 107.011 0.053 A 19 ASP H H 1 7.788 0.006 A 19 ASP HA H 1 4.392 0.004 A 19 ASP HBy H 1 2.968 0.005 A 19 ASP HBx H 1 2.700 0.009 A 19 ASP C C 13 179.020 0.027 A 19 ASP CA C 13 57.443 0.133 A 19 ASP CB C 13 40.914 0.049 A 19 ASP N N 15 122.947 0.044 A 20 ILE H H 1 7.762 0.005 A 20 ILE HA H 1 3.528 0.008 A 20 ILE HB H 1 2.099 0.003 A 20 ILE HD1% H 1 0.687 0.004 A 20 ILE HG1x H 1 0.940 0.006 A 20 ILE HG1y H 1 1.753 0.003 A 20 ILE HG2% H 1 0.800 0.005 A 20 ILE C C 13 177.939 0.076 A 20 ILE CA C 13 66.310 0.088 A 20 ILE CB C 13 38.886 0.065 A 20 ILE CD1 C 13 14.347 0.094 A 20 ILE CG1 C 13 29.869 0.061 A 20 ILE CG2 C 13 18.331 0.083 A 20 ILE N N 15 119.114 0.037 A 21 GLU H H 1 8.113 0.009 A 21 GLU HA H 1 4.582 0.002 A 21 GLU HBx H 1 2.125 0.007 A 21 GLU HBy H 1 2.228 0.004 A 21 GLU HGx H 1 2.527 0.003 A 21 GLU HGy H 1 2.578 0.004 A 21 GLU C C 13 181.888 0.039 A 21 GLU CA C 13 59.207 0.074 A 21 GLU CB C 13 29.414 0.051 A 21 GLU CG C 13 37.076 0.073 A 21 GLU N N 15 119.999 0.096 A 22 ASP H H 1 8.699 0.004 A 22 ASP HA H 1 4.474 0.004 A 22 ASP HBx H 1 2.722 0.003 A 22 ASP HBy H 1 2.911 0.004 A 22 ASP C C 13 178.184 0.009 A 22 ASP CA C 13 57.335 0.113 A 22 ASP CB C 13 40.867 0.081 A 22 ASP N N 15 122.667 0.015 A 23 ARG H H 1 7.380 0.003 A 23 ARG HA H 1 4.344 0.002 A 23 ARG HBx H 1 1.896 0.010 A 23 ARG HBy H 1 2.393 0.007 A 23 ARG HDx H 1 2.830 0.008 A 23 ARG HDy H 1 3.110 0.003 A 23 ARG HGy H 1 1.884 0.002 A 23 ARG HGx H 1 1.756 0.001 A 23 ARG C C 13 176.101 0.067 A 23 ARG CA C 13 56.652 0.071 A 23 ARG CB C 13 30.797 0.122 A 23 ARG CD C 13 43.651 0.045 A 23 ARG CG C 13 29.329 0.065 A 23 ARG N N 15 116.862 0.036 A 24 GLY H H 1 8.004 0.004 A 24 GLY HAy H 1 4.024 0.004 A 24 GLY HAx H 1 3.688 0.004 A 24 GLY C C 13 174.117 0.021 A 24 GLY CA C 13 45.493 0.062 A 24 GLY N N 15 106.318 0.038 A 25 PHE H H 1 7.550 0.004 A 25 PHE HA H 1 4.622 0.003 A 25 PHE HBx H 1 2.713 0.007 A 25 PHE HBy H 1 2.770 0.003 A 25 PHE HDx H 1 6.984 0.003 A 25 PHE HDy H 1 6.984 0.003 A 25 PHE HEx H 1 7.220 0.005 A 25 PHE HEy H 1 7.220 0.005 A 25 PHE C C 13 174.127 0.024 A 25 PHE CA C 13 56.930 0.055 A 25 PHE CB C 13 41.871 0.077 A 25 PHE CDx C 13 131.867 0.036 A 25 PHE CDy C 13 131.867 0.036 A 25 PHE CEx C 13 132.012 0.174 A 25 PHE CEy C 13 132.012 0.174 A 25 PHE N N 15 118.274 0.057 A 26 ASP H H 1 8.891 0.006 A 26 ASP HA H 1 4.894 0.008 A 26 ASP HBx H 1 2.687 0.004 A 26 ASP HBy H 1 2.727 0.002 A 26 ASP C C 13 177.370 0.045 A 26 ASP CA C 13 53.107 0.078 A 26 ASP CB C 13 44.066 0.066 A 26 ASP N N 15 121.320 0.036 A 27 ARG H H 1 9.033 0.009 A 27 ARG HA H 1 3.842 0.007 A 27 ARG HBy H 1 1.826 0.001 A 27 ARG HBx H 1 1.717 0.009 A 27 ARG HDx H 1 2.511 0.009 A 27 ARG HDy H 1 2.851 0.006 A 27 ARG HGy H 1 1.615 0.006 A 27 ARG HGx H 1 1.342 0.010 A 27 ARG C C 13 176.201 0.000 A 27 ARG CA C 13 59.857 0.077 A 27 ARG CB C 13 29.675 0.042 A 27 ARG CD C 13 43.548 0.047 A 27 ARG CG C 13 25.592 0.091 A 27 ARG N N 15 124.100 0.059 A 28 GLU H H 1 8.362 0.003 A 28 GLU HA H 1 4.037 0.004 A 28 GLU HBy H 1 2.180 0.005 A 28 GLU HBx H 1 2.114 0.004 A 28 GLU HGy H 1 2.361 0.006 A 28 GLU HGx H 1 2.267 0.006 A 28 GLU C C 13 178.889 0.011 A 28 GLU CA C 13 59.255 0.073 A 28 GLU CB C 13 29.450 0.056 A 28 GLU CG C 13 37.387 0.049 A 28 GLU N N 15 118.451 0.043 A 29 GLU H H 1 7.821 0.008 A 29 GLU HA H 1 4.085 0.004 A 29 GLU HBx H 1 2.081 0.002 A 29 GLU HBy H 1 2.357 0.003 A 29 GLU HGy H 1 2.504 0.006 A 29 GLU HGx H 1 2.425 0.003 A 29 GLU C C 13 178.137 0.071 A 29 GLU CA C 13 58.960 0.063 A 29 GLU CB C 13 30.452 0.074 A 29 GLU CG C 13 37.412 0.069 A 29 GLU N N 15 118.302 0.059 A 30 ILE H H 1 7.363 0.003 A 30 ILE HA H 1 3.627 0.004 A 30 ILE HB H 1 1.852 0.008 A 30 ILE HD1% H 1 0.419 0.004 A 30 ILE HG1y H 1 1.465 0.002 A 30 ILE HG1x H 1 1.099 0.003 A 30 ILE HG2% H 1 0.625 0.004 A 30 ILE C C 13 176.229 0.011 A 30 ILE CA C 13 62.063 0.068 A 30 ILE CB C 13 35.940 0.082 A 30 ILE CD1 C 13 11.891 0.041 A 30 ILE CG1 C 13 27.607 0.058 A 30 ILE CG2 C 13 18.706 0.056 A 30 ILE N N 15 115.456 0.069 A 31 TRP H H 1 7.410 0.005 A 31 TRP HA H 1 4.150 0.005 A 31 TRP HBx H 1 2.838 0.011 A 31 TRP HBy H 1 2.974 0.007 A 31 TRP HD1 H 1 6.607 0.004 A 31 TRP HE1 H 1 9.772 0.003 A 31 TRP HE3 H 1 7.293 0.002 A 31 TRP HH2 H 1 7.152 0.006 A 31 TRP HZ2 H 1 7.367 0.003 A 31 TRP HZ3 H 1 7.008 0.003 A 31 TRP C C 13 178.092 0.022 A 31 TRP CA C 13 59.618 0.114 A 31 TRP CB C 13 29.628 0.098 A 31 TRP CD1 C 13 126.047 0.095 A 31 TRP CE3 C 13 120.390 0.003 A 31 TRP CH2 C 13 124.582 0.045 A 31 TRP CZ2 C 13 114.515 0.066 A 31 TRP CZ3 C 13 121.983 0.024 A 31 TRP N N 15 116.714 0.071 A 31 TRP NE1 N 15 127.814 0.032 A 32 TYR H H 1 7.577 0.003 A 32 TYR HA H 1 4.766 0.000 A 32 TYR HBx H 1 2.978 0.007 A 32 TYR HBy H 1 3.154 0.006 A 32 TYR HDx H 1 7.223 0.004 A 32 TYR HDy H 1 7.223 0.004 A 32 TYR HEx H 1 6.819 0.003 A 32 TYR HEy H 1 6.819 0.003 A 32 TYR C C 13 175.767 0.000 A 32 TYR CA C 13 58.632 0.074 A 32 TYR CB C 13 40.222 0.094 A 32 TYR CDx C 13 133.750 0.047 A 32 TYR CDy C 13 133.750 0.047 A 32 TYR CEx C 13 118.164 0.056 A 32 TYR CEy C 13 118.164 0.056 A 32 TYR N N 15 112.769 0.044 A 33 ASN H H 1 8.364 0.005 A 33 ASN HA H 1 5.048 0.005 A 33 ASN HBx H 1 2.720 0.006 A 33 ASN HBy H 1 3.407 0.009 A 33 ASN HD2y H 1 7.797 0.002 A 33 ASN HD2x H 1 7.185 0.002 A 33 ASN C C 13 174.851 0.075 A 33 ASN CA C 13 52.320 0.106 A 33 ASN CB C 13 39.213 0.079 A 33 ASN N N 15 120.521 0.039 A 33 ASN ND2 N 15 112.376 0.042 A 34 ARG H H 1 8.830 0.011 A 34 ARG HA H 1 4.185 0.003 A 34 ARG HBx H 1 1.858 0.003 A 34 ARG HBy H 1 1.896 0.001 A 34 ARG HDy H 1 3.296 0.002 A 34 ARG HDx H 1 3.189 0.003 A 34 ARG HGy H 1 1.726 0.012 A 34 ARG HGx H 1 1.701 0.006 A 34 ARG C C 13 178.509 0.000 A 34 ARG CA C 13 58.504 0.048 A 34 ARG CB C 13 29.493 0.041 A 34 ARG CD C 13 43.131 0.091 A 34 ARG CG C 13 27.098 0.051 A 34 ARG N N 15 126.163 0.033 A 35 GLU H H 1 8.380 0.005 A 35 GLU HA H 1 4.160 0.003 A 35 GLU HBy H 1 2.229 0.003 A 35 GLU HBx H 1 2.122 0.008 A 35 GLU HGy H 1 2.368 0.002 A 35 GLU HGx H 1 2.260 0.008 A 35 GLU C C 13 179.839 0.056 A 35 GLU CA C 13 60.191 0.062 A 35 GLU CB C 13 29.433 0.048 A 35 GLU CG C 13 36.801 0.033 A 35 GLU N N 15 118.994 0.030 A 36 ARG H H 1 7.686 0.005 A 36 ARG HA H 1 4.400 0.003 A 36 ARG HBx H 1 1.899 0.003 A 36 ARG HBy H 1 1.940 0.001 A 36 ARG HDy H 1 3.408 0.006 A 36 ARG HDx H 1 3.353 0.003 A 36 ARG HGx H 1 1.763 0.006 A 36 ARG HGy H 1 1.803 0.001 A 36 ARG C C 13 178.217 0.035 A 36 ARG CA C 13 57.394 0.066 A 36 ARG CB C 13 29.535 0.072 A 36 ARG CD C 13 42.023 0.029 A 36 ARG CG C 13 26.708 0.067 A 36 ARG N N 15 119.197 0.060 A 37 SER H H 1 8.282 0.004 A 37 SER HA H 1 3.899 0.003 A 37 SER HBx H 1 3.720 0.008 A 37 SER HBy H 1 3.978 0.004 A 37 SER C C 13 178.298 0.000 A 37 SER CA C 13 62.455 0.225 A 37 SER CB C 13 62.542 0.061 A 37 SER N N 15 114.607 0.028 A 38 GLU H H 1 7.849 0.005 A 38 GLU HA H 1 3.756 0.004 A 38 GLU HBy H 1 2.180 0.007 A 38 GLU HBx H 1 2.117 0.001 A 38 GLU HGy H 1 2.520 0.005 A 38 GLU HGx H 1 2.419 0.003 A 38 GLU C C 13 177.182 0.000 A 38 GLU CA C 13 60.298 0.080 A 38 GLU CB C 13 29.274 0.092 A 38 GLU CG C 13 37.769 0.016 A 38 GLU N N 15 121.063 0.053 A 39 GLU H H 1 7.686 0.005 A 39 GLU HA H 1 4.229 0.006 A 39 GLU HBx H 1 2.388 0.011 A 39 GLU HBy H 1 2.528 0.010 A 39 GLU HGy H 1 2.712 0.008 A 39 GLU HGx H 1 2.424 0.006 A 39 GLU C C 13 179.781 0.009 A 39 GLU CA C 13 60.172 0.074 A 39 GLU CB C 13 30.059 0.080 A 39 GLU CG C 13 36.940 0.052 A 39 GLU N N 15 119.119 0.030 A 40 LEU H H 1 7.739 0.005 A 40 LEU HA H 1 3.692 0.006 A 40 LEU HBx H 1 0.394 0.010 A 40 LEU HBy H 1 1.629 0.009 A 40 LEU HDx% H 1 0.378 0.005 A 40 LEU HG H 1 0.540 0.008 A 40 LEU C C 13 177.155 0.006 A 40 LEU CA C 13 58.264 0.075 A 40 LEU CB C 13 40.449 0.096 A 40 LEU CDx C 13 22.948 0.051 A 40 LEU CG C 13 26.470 0.056 A 40 LEU N N 15 120.164 0.046 A 41 PHE H H 1 7.825 0.008 A 41 PHE HA H 1 3.805 0.007 A 41 PHE HBx H 1 2.775 0.006 A 41 PHE HBy H 1 3.019 0.009 A 41 PHE HDx H 1 7.026 0.002 A 41 PHE HDy H 1 7.026 0.002 A 41 PHE HEx H 1 7.286 0.007 A 41 PHE HEy H 1 7.286 0.007 A 41 PHE C C 13 176.387 0.075 A 41 PHE CA C 13 61.364 0.056 A 41 PHE CB C 13 38.069 0.042 A 41 PHE CDx C 13 129.415 0.048 A 41 PHE CDy C 13 129.415 0.048 A 41 PHE CEx C 13 131.828 0.145 A 41 PHE CEy C 13 131.828 0.145 A 41 PHE N N 15 118.207 0.051 A 42 TRP H H 1 8.266 0.005 A 42 TRP HA H 1 4.124 0.003 A 42 TRP HBx H 1 3.160 0.002 A 42 TRP HBy H 1 3.372 0.003 A 42 TRP HD1 H 1 7.386 0.002 A 42 TRP HE1 H 1 10.804 0.005 A 42 TRP HE3 H 1 7.537 0.003 A 42 TRP HH2 H 1 7.414 0.003 A 42 TRP HZ2 H 1 7.628 0.005 A 42 TRP HZ3 H 1 7.159 0.002 A 42 TRP C C 13 179.071 0.029 A 42 TRP CA C 13 60.079 0.080 A 42 TRP CB C 13 29.454 0.055 A 42 TRP CD1 C 13 129.632 0.034 A 42 TRP CE3 C 13 121.407 0.129 A 42 TRP CH2 C 13 124.397 0.002 A 42 TRP CZ2 C 13 114.896 0.064 A 42 TRP CZ3 C 13 120.458 0.000 A 42 TRP N N 15 117.448 0.038 A 42 TRP NE1 N 15 128.852 0.027 A 43 GLU H H 1 7.918 0.005 A 43 GLU HA H 1 4.159 0.004 A 43 GLU HBx H 1 2.238 0.006 A 43 GLU HBy H 1 2.337 0.003 A 43 GLU HGx H 1 2.235 0.003 A 43 GLU HGy H 1 2.513 0.007 A 43 GLU C C 13 179.556 0.024 A 43 GLU CA C 13 60.181 0.088 A 43 GLU CB C 13 29.502 0.070 A 43 GLU CG C 13 36.849 0.072 A 43 GLU N N 15 120.573 0.052 A 44 VAL H H 1 7.947 0.008 A 44 VAL HA H 1 3.445 0.002 A 44 VAL HB H 1 1.684 0.009 A 44 VAL HGx% H 1 0.459 0.003 A 44 VAL HGy% H 1 0.233 0.002 A 44 VAL C C 13 178.356 0.000 A 44 VAL CA C 13 66.390 0.067 A 44 VAL CB C 13 31.220 0.091 A 44 VAL CGy C 13 22.148 0.040 A 44 VAL CGx C 13 21.064 0.068 A 44 VAL N N 15 119.502 0.061 A 45 MET H H 1 7.998 0.007 A 45 MET HA H 1 4.118 0.002 A 45 MET HBy H 1 1.772 0.002 A 45 MET HE% H 1 1.676 0.005 A 45 MET HGy H 1 1.411 0.002 A 45 MET C C 13 179.207 0.000 A 45 MET CA C 13 56.677 0.058 A 45 MET CB C 13 31.094 0.070 A 45 MET CE C 13 17.460 0.073 A 45 MET CG C 13 33.001 0.018 A 45 MET N N 15 117.691 0.041 A 46 ASP H H 1 7.773 0.006 A 46 ASP HA H 1 4.541 0.003 A 46 ASP HBy H 1 2.870 0.005 A 46 ASP HBx H 1 2.721 0.001 A 46 ASP CA C 13 56.942 0.064 A 46 ASP CB C 13 41.428 0.055 A 46 ASP N N 15 119.109 0.036 A 47 GLU H H 1 7.608 0.007 A 47 GLU HA H 1 4.168 0.003 A 47 GLU HBy H 1 2.119 0.005 A 47 GLU HGy H 1 2.435 0.010 A 47 GLU HGx H 1 2.211 0.009 A 47 GLU C C 13 177.957 0.037 A 47 GLU CA C 13 57.977 0.054 A 47 GLU CB C 13 30.403 0.093 A 47 GLU CG C 13 36.480 0.032 A 47 GLU N N 15 118.018 0.058 A 48 VAL H H 1 7.508 0.004 A 48 VAL HA H 1 4.105 0.009 A 48 VAL HB H 1 2.110 0.007 A 48 VAL HGx% H 1 0.983 0.004 A 48 VAL HGy% H 1 0.817 0.005 A 48 VAL CA C 13 62.377 0.031 A 48 VAL CB C 13 33.866 0.097 A 48 VAL CGy C 13 22.166 0.052 A 48 VAL CGx C 13 20.842 0.145 A 48 VAL N N 15 115.277 0.052 A 49 HIS H H 1 8.099 0.003 A 49 HIS HA H 1 4.611 0.003 A 49 HIS HBx H 1 3.228 0.004 A 49 HIS HBy H 1 3.296 0.005 A 49 HIS HD2 H 1 7.151 0.005 A 49 HIS HE1 H 1 8.199 0.008 A 49 HIS CA C 13 58.000 0.022 A 49 HIS CB C 13 29.529 0.061 A 49 HIS CD2 C 13 120.592 0.045 A 49 HIS CE1 C 13 137.262 0.003 A 49 HIS N N 15 121.222 0.017 A 50 GLU HA H 1 4.222 0.003 A 50 GLU HBx H 1 1.950 0.000 A 50 GLU HBy H 1 2.102 0.010 A 50 GLU HGx H 1 2.253 0.000 A 50 GLU CA C 13 57.629 0.106 A 50 GLU CB C 13 30.423 0.053 A 50 GLU CG C 13 36.469 0.006 A 51 GLU H H 1 8.121 0.010 A 51 GLU HA H 1 4.234 0.001 A 51 GLU HBx H 1 1.883 0.003 A 51 GLU HBy H 1 1.980 0.004 A 51 GLU HGy H 1 2.275 0.005 A 51 GLU HGx H 1 2.186 0.004 A 51 GLU C C 13 176.279 0.008 A 51 GLU CA C 13 56.547 0.055 A 51 GLU CB C 13 30.581 0.044 A 51 GLU CG C 13 36.474 0.015 A 51 GLU N N 15 119.589 0.041 A 52 GLU H H 1 8.412 0.014 A 52 GLU HA H 1 4.310 0.009 A 52 GLU HBy H 1 1.969 0.006 A 52 GLU HBx H 1 1.882 0.003 A 52 GLU HGy H 1 2.275 0.003 A 52 GLU HGx H 1 2.192 0.007 A 52 GLU C C 13 176.127 0.157 A 52 GLU CA C 13 56.508 0.100 A 52 GLU CB C 13 30.565 0.064 A 52 GLU CG C 13 36.466 0.015 A 52 GLU N N 15 122.410 0.067 A 53 GLU H H 1 8.361 0.009 A 53 GLU HA H 1 4.294 0.002 A 53 GLU HBy H 1 2.099 0.002 A 53 GLU HBx H 1 1.896 0.000 A 53 GLU HGy H 1 2.267 0.039 A 53 GLU HGx H 1 2.192 0.005 A 53 GLU C C 13 176.242 0.005 A 53 GLU CA C 13 56.607 0.161 A 53 GLU CB C 13 30.439 0.042 A 53 GLU CG C 13 36.482 0.016 A 53 GLU N N 15 121.407 0.033 A 54 PHE H H 1 8.147 0.004 A 54 PHE HA H 1 4.594 0.005 A 54 PHE HBy H 1 3.101 0.002 A 54 PHE HBx H 1 2.942 0.002 A 54 PHE HDx H 1 7.208 0.000 A 54 PHE HDy H 1 7.208 0.000 A 54 PHE C C 13 176.021 0.158 A 54 PHE CA C 13 57.554 0.273 A 54 PHE CB C 13 40.192 0.326 A 54 PHE CDx C 13 133.867 0.000 A 54 PHE CDy C 13 133.867 0.000 A 54 PHE N N 15 121.128 0.106 A 55 ALA H H 1 8.124 0.008 A 55 ALA HA H 1 4.421 0.025 A 55 ALA HB% H 1 1.298 0.006 A 55 ALA C C 13 177.391 0.034 A 55 ALA CA C 13 52.373 0.079 A 55 ALA CB C 13 19.512 0.105 A 55 ALA N N 15 126.124 0.092 A 56 VAL H H 1 7.958 0.013 A 56 VAL HA H 1 4.133 0.013 A 56 VAL HB H 1 1.991 0.013 A 56 VAL HGx% H 1 0.805 0.001 A 56 VAL HGy% H 1 0.939 0.001 A 56 VAL C C 13 176.128 0.005 A 56 VAL CA C 13 62.306 0.069 A 56 VAL CB C 13 33.274 0.248 A 56 VAL CGx C 13 21.556 0.037 A 56 VAL CGy C 13 21.588 0.125 A 56 VAL N N 15 119.019 0.060 A 57 GLU H H 1 8.413 0.010 A 57 GLU HA H 1 4.495 0.007 A 57 GLU HBy H 1 2.050 0.004 A 57 GLU HBx H 1 1.903 0.001 A 57 GLU HGx H 1 1.930 0.000 A 57 GLU HGy H 1 2.175 0.009 A 57 GLU C C 13 176.082 0.202 A 57 GLU CA C 13 56.056 0.092 A 57 GLU CB C 13 31.303 0.074 A 57 GLU CG C 13 36.411 0.035 A 57 GLU N N 15 124.588 0.086 A 58 GLY H H 1 8.040 0.007 A 58 GLY HAx H 1 4.013 0.017 A 58 GLY HAy H 1 4.220 0.006 A 58 GLY C C 13 170.660 0.000 A 58 GLY CA C 13 44.857 0.093 A 58 GLY N N 15 110.794 0.045 A 59 PRO HA H 1 4.431 0.006 A 59 PRO HBy H 1 2.204 0.007 A 59 PRO HBx H 1 1.656 0.022 A 59 PRO HDy H 1 3.574 0.007 A 59 PRO HGx H 1 1.963 0.007 A 59 PRO CA C 13 63.088 0.097 A 59 PRO CB C 13 32.474 0.102 A 59 PRO CD C 13 49.913 0.031 A 59 PRO CG C 13 27.494 0.080 A 60 LEU H H 1 8.367 0.004 A 60 LEU HBy H 1 1.549 0.007 A 60 LEU HBx H 1 1.121 0.007 A 60 LEU C C 13 176.392 0.000 A 60 LEU CA C 13 53.924 0.156 A 60 LEU CB C 13 45.038 0.046 A 60 LEU CDy C 13 23.829 0.000 A 60 LEU CG C 13 25.936 0.002 A 60 LEU N N 15 120.609 0.062 A 61 TRP H H 1 9.101 0.008 A 61 TRP HA H 1 4.961 0.000 A 61 TRP HBx H 1 3.024 0.009 A 61 TRP HBy H 1 3.134 0.005 A 61 TRP HD1 H 1 7.099 0.005 A 61 TRP HE1 H 1 10.051 0.006 A 61 TRP HE3 H 1 7.509 0.002 A 61 TRP HZ2 H 1 7.395 0.001 A 61 TRP HZ3 H 1 7.056 0.000 A 61 TRP CA C 13 56.133 0.172 A 61 TRP CB C 13 30.866 0.101 A 61 TRP CD1 C 13 126.262 0.078 A 61 TRP CE3 C 13 121.287 0.039 A 61 TRP CZ2 C 13 114.493 0.000 A 61 TRP CZ3 C 13 119.860 0.000 A 61 TRP N N 15 124.050 0.042 A 61 TRP NE1 N 15 128.938 0.050 A 62 ILE H H 1 7.863 0.023 A 62 ILE HB H 1 1.431 0.013 A 62 ILE HD1% H 1 0.505 0.011 A 62 ILE HG2% H 1 0.470 0.006 A 62 ILE C C 13 174.576 0.000 A 62 ILE CA C 13 60.556 0.174 A 62 ILE CB C 13 40.639 0.019 A 62 ILE CD1 C 13 13.495 0.137 A 62 ILE CG1 C 13 27.566 0.061 A 62 ILE CG2 C 13 17.218 0.096 A 62 ILE N N 15 121.315 0.094 A 63 GLN H H 1 8.881 0.006 A 63 GLN HA H 1 4.534 0.004 A 63 GLN HBy H 1 1.950 0.000 A 63 GLN HE2x H 1 6.670 0.003 A 63 GLN HE2y H 1 7.222 0.007 A 63 GLN HGx H 1 1.963 0.006 A 63 GLN HGy H 1 2.033 0.001 A 63 GLN C C 13 173.768 0.055 A 63 GLN CA C 13 54.409 0.075 A 63 GLN CB C 13 30.309 0.019 A 63 GLN CG C 13 34.433 0.042 A 63 GLN N N 15 127.300 0.056 A 63 GLN NE2 N 15 111.676 0.011 A 64 VAL H H 1 8.330 0.008 A 64 VAL HA H 1 4.677 0.008 A 64 VAL HB H 1 1.669 0.005 A 64 VAL HGx% H 1 0.537 0.004 A 64 VAL HGy% H 1 0.640 0.005 A 64 VAL C C 13 174.737 0.017 A 64 VAL CA C 13 60.965 0.100 A 64 VAL CB C 13 34.420 0.120 A 64 VAL CGy C 13 22.860 0.075 A 64 VAL CGx C 13 21.124 0.078 A 64 VAL N N 15 123.414 0.050 A 65 GLN H H 1 8.938 0.005 A 65 GLN HA H 1 4.751 0.000 A 65 GLN HBy H 1 2.033 0.002 A 65 GLN HBx H 1 1.971 0.003 A 65 GLN HE2y H 1 7.472 0.002 A 65 GLN HE2x H 1 6.669 0.003 A 65 GLN HGy H 1 2.240 0.007 A 65 GLN C C 13 174.043 0.101 A 65 GLN CA C 13 54.421 0.029 A 65 GLN CB C 13 31.956 0.078 A 65 GLN CG C 13 33.986 0.055 A 65 GLN N N 15 125.152 0.024 A 65 GLN NE2 N 15 111.518 0.055 A 66 ALA H H 1 8.808 0.004 A 66 ALA HA H 1 4.636 0.003 A 66 ALA HB% H 1 1.229 0.003 A 66 ALA C C 13 176.740 0.076 A 66 ALA CA C 13 52.801 0.100 A 66 ALA CB C 13 19.346 0.088 A 66 ALA N N 15 127.534 0.034 A 67 LEU H H 1 8.541 0.004 A 67 LEU HA H 1 4.785 0.000 A 67 LEU HBx H 1 1.671 0.003 A 67 LEU HBy H 1 1.820 0.005 A 67 LEU HDx% H 1 0.800 0.009 A 67 LEU HDy% H 1 0.826 0.004 A 67 LEU HG H 1 1.557 0.004 A 67 LEU C C 13 177.190 0.093 A 67 LEU CA C 13 53.585 0.089 A 67 LEU CB C 13 43.846 0.079 A 67 LEU CDx C 13 23.505 0.073 A 67 LEU CDy C 13 25.972 0.067 A 67 LEU CG C 13 27.909 0.107 A 67 LEU N N 15 124.609 0.024 A 68 ASP H H 1 8.539 0.010 A 68 ASP HA H 1 4.430 0.001 A 68 ASP HBx H 1 2.718 0.006 A 68 ASP C C 13 177.319 0.000 A 68 ASP CA C 13 58.090 0.036 A 68 ASP CB C 13 40.915 0.061 A 68 ASP N N 15 120.713 0.065 A 69 LYS HA H 1 4.602 0.003 A 69 LYS HBy H 1 2.119 0.005 A 69 LYS HBx H 1 1.718 0.005 A 69 LYS HDx H 1 1.654 0.001 A 69 LYS HDy H 1 1.734 0.009 A 69 LYS HEy H 1 3.005 0.001 A 69 LYS HGy H 1 1.442 0.001 A 69 LYS HGx H 1 1.401 0.003 A 69 LYS C C 13 176.282 0.000 A 69 LYS CA C 13 55.817 0.087 A 69 LYS CB C 13 33.563 0.103 A 69 LYS CD C 13 29.416 0.051 A 69 LYS CE C 13 42.432 0.008 A 69 LYS CG C 13 25.384 0.028 A 70 GLY H H 1 6.977 0.004 A 70 GLY HAx H 1 2.152 0.004 A 70 GLY HAy H 1 3.793 0.005 A 70 GLY C C 13 169.572 0.047 A 70 GLY CA C 13 45.365 0.070 A 70 GLY N N 15 110.325 0.046 A 71 LEU H H 1 8.032 0.014 A 71 LEU HA H 1 5.016 0.002 A 71 LEU HBx H 1 1.152 0.007 A 71 LEU HBy H 1 1.298 0.003 A 71 LEU HDx% H 1 0.825 0.003 A 71 LEU HDy% H 1 0.702 0.003 A 71 LEU HG H 1 1.432 0.004 A 71 LEU C C 13 174.299 0.164 A 71 LEU CA C 13 53.057 0.065 A 71 LEU CB C 13 45.892 0.086 A 71 LEU CDx C 13 26.004 0.061 A 71 LEU CDy C 13 26.055 0.043 A 71 LEU CG C 13 26.497 0.004 A 71 LEU N N 15 116.716 0.052 A 72 GLU H H 1 8.739 0.005 A 72 GLU HA H 1 4.966 0.004 A 72 GLU HBy H 1 1.901 0.006 A 72 GLU HBx H 1 1.865 0.006 A 72 GLU HGx H 1 1.886 0.005 A 72 GLU HGy H 1 2.054 0.008 A 72 GLU C C 13 174.588 0.047 A 72 GLU CA C 13 55.034 0.065 A 72 GLU CB C 13 33.392 0.068 A 72 GLU CG C 13 38.159 0.068 A 72 GLU N N 15 120.507 0.035 A 73 ILE H H 1 8.755 0.006 A 73 ILE HA H 1 4.526 0.003 A 73 ILE HD1% H 1 0.408 0.003 A 73 ILE HG1x H 1 0.601 0.001 A 73 ILE HG1y H 1 1.056 0.003 A 73 ILE HG2% H 1 0.363 0.003 A 73 ILE C C 13 173.786 0.000 A 73 ILE CA C 13 60.428 0.053 A 73 ILE CB C 13 39.105 0.110 A 73 ILE CD1 C 13 13.931 0.026 A 73 ILE CG1 C 13 28.419 0.029 A 73 ILE CG2 C 13 18.300 0.043 A 73 ILE N N 15 127.226 0.035 A 74 ILE H H 1 8.691 0.005 A 74 ILE HA H 1 4.666 0.001 A 74 ILE HB H 1 1.532 0.003 A 74 ILE HD1% H 1 0.694 0.006 A 74 ILE HG1x H 1 0.732 0.007 A 74 ILE HG1y H 1 1.433 0.006 A 74 ILE HG2% H 1 0.687 0.008 A 74 ILE C C 13 175.304 0.000 A 74 ILE CA C 13 60.808 0.107 A 74 ILE CB C 13 40.432 0.062 A 74 ILE CD1 C 13 14.032 0.048 A 74 ILE CG1 C 13 28.450 0.051 A 74 ILE CG2 C 13 18.337 0.053 A 74 ILE N N 15 126.107 0.058 A 75 VAL H H 1 9.178 0.006 A 75 VAL HA H 1 4.605 0.003 A 75 VAL HB H 1 1.486 0.012 A 75 VAL HGx% H 1 0.349 0.001 A 75 VAL HGy% H 1 0.125 0.005 A 75 VAL C C 13 174.187 0.000 A 75 VAL CA C 13 61.420 0.033 A 75 VAL CB C 13 33.645 0.076 A 75 VAL CGx C 13 21.079 0.033 A 75 VAL CGy C 13 21.921 0.053 A 75 VAL N N 15 128.967 0.050 A 76 THR HA H 1 5.743 0.007 A 76 THR HB H 1 4.063 0.005 A 76 THR HG2% H 1 1.313 0.003 A 76 THR CA C 13 59.957 0.061 A 76 THR CB C 13 71.833 0.099 A 76 THR CG2 C 13 20.921 0.062 A 77 LYS H H 1 8.688 0.005 A 77 LYS HA H 1 4.588 0.000 A 77 LYS HBx H 1 1.813 0.014 A 77 LYS HBy H 1 1.855 0.000 A 77 LYS HDy H 1 1.510 0.001 A 77 LYS HEy H 1 2.788 0.001 A 77 LYS HEx H 1 2.726 0.001 A 77 LYS HGy H 1 1.510 0.004 A 77 LYS HGx H 1 1.444 0.003 A 77 LYS CA C 13 55.751 0.053 A 77 LYS CB C 13 33.947 0.010 A 77 LYS CD C 13 29.953 0.029 A 77 LYS CE C 13 42.236 0.027 A 77 LYS CG C 13 24.929 0.019 A 77 LYS N N 15 124.204 0.063 A 78 ALA H H 1 8.137 0.004 A 78 ALA HA H 1 3.976 0.008 A 78 ALA HB% H 1 1.029 0.007 A 78 ALA C C 13 176.776 0.000 A 78 ALA CA C 13 52.431 0.084 A 78 ALA CB C 13 19.542 0.104 A 78 ALA N N 15 125.102 0.082 A 79 GLN HA H 1 4.085 0.013 A 79 GLN HBy H 1 1.888 0.009 A 79 GLN HE2x H 1 6.703 0.004 A 79 GLN HE2y H 1 7.310 0.008 A 79 GLN HGy H 1 2.085 0.010 A 79 GLN CA C 13 55.540 0.004 A 79 GLN CB C 13 29.617 0.235 A 79 GLN CG C 13 33.823 0.141 A 79 GLN NE2 N 15 112.181 0.017 A 80 LEU HA H 1 4.295 0.001 A 80 LEU HBy H 1 1.535 0.004 A 80 LEU CA C 13 55.034 0.034 A 80 LEU CB C 13 42.320 0.054 A 81 SER H H 1 8.214 0.006 A 81 SER HA H 1 4.291 0.005 A 81 SER HBx H 1 3.736 0.007 A 81 SER HBy H 1 3.772 0.004 A 81 SER C C 13 174.770 0.027 A 81 SER CA C 13 58.674 0.143 A 81 SER CB C 13 63.931 0.042 A 81 SER N N 15 116.580 0.032 A 82 LYS H H 1 8.255 0.007 A 82 LYS HA H 1 4.283 0.027 A 82 LYS HBx H 1 1.744 0.000 A 82 LYS HBy H 1 1.810 0.000 A 82 LYS HDy H 1 1.624 0.000 A 82 LYS HEy H 1 2.949 0.000 A 82 LYS HGy H 1 1.353 0.000 A 82 LYS C C 13 176.222 0.160 A 82 LYS CA C 13 56.542 0.177 A 82 LYS CB C 13 32.941 0.037 A 82 LYS CD C 13 29.305 0.000 A 82 LYS CE C 13 42.447 0.000 A 82 LYS CG C 13 24.866 0.000 A 82 LYS N N 15 122.968 0.076 A 83 ASP H H 1 8.158 0.009 A 83 ASP HA H 1 4.546 0.007 A 83 ASP HBx H 1 2.523 0.003 A 83 ASP HBy H 1 2.703 0.006 A 83 ASP C C 13 176.527 0.016 A 83 ASP CA C 13 54.864 0.103 A 83 ASP CB C 13 41.156 0.076 A 83 ASP N N 15 120.305 0.036 A 84 LEU H H 1 7.955 0.010 A 84 LEU HA H 1 4.183 0.002 A 84 LEU HBy H 1 1.635 0.011 A 84 LEU HBx H 1 1.542 0.006 A 84 LEU HDx% H 1 0.867 0.009 A 84 LEU HDy% H 1 0.811 0.005 A 84 LEU HG H 1 1.590 0.005 A 84 LEU C C 13 177.585 0.017 A 84 LEU CA C 13 56.042 0.104 A 84 LEU CB C 13 42.379 0.071 A 84 LEU CDy C 13 25.302 0.107 A 84 LEU CDx C 13 23.566 0.034 A 84 LEU CG C 13 27.357 0.133 A 84 LEU N N 15 121.499 0.055 A 85 ASP H H 1 8.207 0.007 A 85 ASP HA H 1 4.500 0.003 A 85 ASP HBy H 1 2.658 0.005 A 85 ASP HBx H 1 2.634 0.004 A 85 ASP C C 13 176.445 0.007 A 85 ASP CA C 13 55.143 0.088 A 85 ASP CB C 13 41.116 0.042 A 85 ASP N N 15 119.668 0.032 A 86 LYS H H 1 7.843 0.007 A 86 LYS HA H 1 4.253 0.006 A 86 LYS HBy H 1 1.811 0.011 A 86 LYS HBx H 1 1.713 0.006 A 86 LYS HDy H 1 1.624 0.007 A 86 LYS HEy H 1 2.947 0.002 A 86 LYS HGx H 1 1.354 0.003 A 86 LYS HGy H 1 1.396 0.000 A 86 LYS C C 13 176.336 0.125 A 86 LYS CA C 13 56.519 0.098 A 86 LYS CB C 13 33.072 0.058 A 86 LYS CD C 13 29.285 0.045 A 86 LYS CE C 13 42.351 0.027 A 86 LYS CG C 13 24.912 0.033 A 86 LYS N N 15 119.760 0.036 A 87 LEU H H 1 8.008 0.003 A 87 LEU HA H 1 4.309 0.005 A 87 LEU HBx H 1 1.540 0.007 A 87 LEU HBy H 1 1.640 0.008 A 87 LEU HDx% H 1 0.871 0.009 A 87 LEU HDy% H 1 0.796 0.013 A 87 LEU HG H 1 1.571 0.005 A 87 LEU C C 13 176.952 0.083 A 87 LEU CA C 13 55.369 0.061 A 87 LEU CB C 13 42.407 0.093 A 87 LEU CDy C 13 25.173 0.053 A 87 LEU CDx C 13 23.575 0.038 A 87 LEU CG C 13 27.261 0.100 A 87 LEU N N 15 122.086 0.059 A 88 VAL H H 1 7.919 0.010 A 88 VAL HA H 1 4.374 0.004 A 88 VAL HB H 1 2.047 0.006 A 88 VAL HGx% H 1 0.909 0.004 A 88 VAL HGy% H 1 0.934 0.011 A 88 VAL C C 13 174.225 0.000 A 88 VAL CA C 13 59.992 0.062 A 88 VAL CB C 13 32.946 0.068 A 88 VAL CGx C 13 20.750 0.055 A 88 VAL CGy C 13 21.347 0.017 A 88 VAL N N 15 122.409 0.049 A 89 PRO HA H 1 4.370 0.005 A 89 PRO HBx H 1 1.914 0.005 A 89 PRO HBy H 1 2.237 0.005 A 89 PRO HDx H 1 3.651 0.005 A 89 PRO HDy H 1 3.816 0.004 A 89 PRO HGx H 1 1.919 0.004 A 89 PRO HGy H 1 2.027 0.006 A 89 PRO C C 13 176.035 0.028 A 89 PRO CA C 13 63.592 0.108 A 89 PRO CB C 13 32.218 0.118 A 89 PRO CD C 13 51.318 0.053 A 89 PRO CG C 13 27.582 0.057 A 90 ARG H H 1 7.908 0.004 A 90 ARG HA H 1 4.138 0.004 A 90 ARG HBy H 1 1.809 0.006 A 90 ARG HBx H 1 1.671 0.003 A 90 ARG HDx H 1 3.140 0.005 A 90 ARG HGy H 1 1.591 0.007 A 90 ARG C C 13 181.180 0.000 A 90 ARG CA C 13 57.485 0.065 A 90 ARG CB C 13 31.867 0.055 A 90 ARG CD C 13 43.676 0.045 A 90 ARG CG C 13 27.426 0.033 A 90 ARG N N 15 126.764 0.033 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 1 MET HE% A 1 MET HA 1.0 . 4.49 2 2 A 1 MET HE% A 1 MET HGx 1.0 . 3.31 3 3 A 1 MET HE% A 1 MET HGy 1.0 . 3.35 4 4 A 1 MET HGy A 1 MET HBy 1.0 . 3.55 5 5 A 1 MET HE% A 1 MET HGx 1.0 . 3.35 6 6 A 1 MET HA A 1 MET HBx 1.0 . 3.70 7 7 A 1 MET HA A 1 MET HGx 1.0 . 3.91 8 8 A 1 MET HGx A 1 MET HBx 1.0 . 3.73 9 9 A 1 MET HGx A 1 MET HBy 1.0 . 3.99 10 10 A 1 MET HA A 1 MET HBy 1.0 . 3.64 11 11 A 1 MET HGx A 1 MET HBy 1.0 . 3.55 12 12 A 1 MET HA A 1 MET HGy 1.0 . 4.27 13 13 A 1 MET HA A 2 GLU H 1.0 . 3.93 14 14 A 2 GLU H A 2 GLU HBy 1.0 . 3.88 15 15 A 1 MET HBx A 2 GLU H 1.0 . 0.00 16 16 A 2 GLU H A 2 GLU HA 1.0 . 3.21 17 17 A 2 GLU H A 2 GLU HBx 1.0 . 3.17 18 18 A 2 GLU HA A 2 GLU HBx 1.0 . 3.45 19 19 A 2 GLU HA A 2 GLU HGy 1.0 . 3.99 20 20 A 2 GLU H A 2 GLU HA 1.0 . 3.10 21 21 A 2 GLU HA A 2 GLU HBx 1.0 . 3.40 22 22 A 2 GLU HA A 2 GLU HGy 1.0 . 3.60 23 23 A 2 GLU HBy A 2 GLU HGy 1.0 . 3.55 24 24 A 2 GLU HBy A 2 GLU HA 1.0 . 3.35 25 25 A 2 GLU H A 2 GLU HBy 1.0 . 3.32 26 26 A 2 GLU HBy A 2 GLU HA 1.0 . 3.33 27 27 A 2 GLU HBx A 2 GLU HGy 1.0 . 3.55 28 28 A 2 GLU HBx A 3 ILE H 1.0 . 4.72 29 29 A 2 GLU HA A 3 ILE H 1.0 . 3.38 30 30 A 2 GLU HBy A 3 ILE H 1.0 . 4.95 31 31 A 2 GLU HA A 3 ILE H 1.0 . 3.13 32 32 A 2 GLU HBx A 14 TYR H 1.0 . 4.46 33 33 A 2 GLU HBy A 14 TYR H 1.0 . 4.46 34 34 A 2 GLU HA A 14 TYR H 1.0 . 5.29 35 35 A 2 GLU HA A 14 TYR H 1.0 . 4.65 36 36 A 2 GLU HBy A 14 TYR H 1.0 . 3.94 37 37 A 2 GLU HBx A 14 TYR H 1.0 . 3.85 38 38 A 1 MET HE% A 3 ILE HD1% 1.0 . 4.65 39 39 A 1 MET HGx A 3 ILE HD1% 1.0 . 4.20 40 40 A 1 MET HE% A 3 ILE HD1% 1.0 . 2.82 41 41 A 1 MET HBy A 3 ILE HD1% 1.0 . 3.85 42 42 A 3 ILE HD1% A 47 GLU HBy 1.0 . 0.00 43 43 A 1 MET HGy A 3 ILE HD1% 1.0 . 4.32 44 44 A 2 GLU HGy A 3 ILE H 1.0 . 5.29 45 45 A 2 GLU HGy A 3 ILE H 1.0 . 4.65 46 46 A 2 GLU H A 2 GLU HGy 1.0 . 0.00 47 47 A 3 ILE H A 3 ILE HG1y 1.0 . 4.52 48 48 A 3 ILE H A 3 ILE HB 1.0 . 4.10 49 49 A 3 ILE H A 3 ILE HG1x 1.0 . 4.35 50 50 A 3 ILE H A 3 ILE HD1% 1.0 . 4.18 51 51 A 3 ILE H A 3 ILE HG2% 1.0 . 0.00 52 52 A 3 ILE H A 3 ILE HG1y 1.0 . 5.99 53 53 A 3 ILE HG1x A 3 ILE HA 1.0 . 4.15 54 54 A 3 ILE H A 3 ILE HB 1.0 . 3.95 55 55 A 3 ILE HD1% A 3 ILE HG1x 1.0 . 2.55 56 56 A 3 ILE HD1% A 3 ILE HG1y 1.0 . 2.46 57 57 A 3 ILE HG2% A 3 ILE HA 1.0 . 3.48 58 58 A 3 ILE HB A 3 ILE HA 1.0 . 3.89 59 59 A 2 GLU HA A 3 ILE HB 1.0 . 0.00 60 60 A 3 ILE HD1% A 3 ILE HG1y 1.0 . 2.71 61 61 A 3 ILE HG1y A 3 ILE HG2% 1.0 . 0.00 62 62 A 3 ILE H A 3 ILE HD1% 1.0 . 3.62 63 63 A 3 ILE H A 3 ILE HG2% 1.0 . 4.58 64 64 A 3 ILE HG1y A 3 ILE HB 1.0 . 4.03 65 65 A 3 ILE HG1y A 3 ILE HB 1.0 . 3.51 66 66 A 3 ILE HD1% A 3 ILE HB 1.0 . 3.00 67 67 A 3 ILE HB A 3 ILE HG2% 1.0 . 0.00 68 68 A 3 ILE HD1% A 3 ILE HA 1.0 . 3.55 69 69 A 3 ILE HD1% A 3 ILE HB 1.0 . 3.53 70 70 A 3 ILE H A 3 ILE HG1x 1.0 . 4.93 71 71 A 3 ILE HG1y A 3 ILE HA 1.0 . 3.63 72 72 A 3 ILE HG2% A 4 GLU HA 1.0 . 3.77 73 73 A 3 ILE HG2% A 5 ARG HDx 1.0 . 4.36 74 74 A 3 ILE HG2% A 13 PHE HBy 1.0 . 0.00 75 75 A 3 ILE HD1% A 13 PHE HD% 1.0 . 4.01 76 76 A 3 ILE HD1% A 13 PHE HD% 1.0 . 4.18 77 77 A 3 ILE HD1% A 13 PHE HBy 1.0 . 4.65 78 78 A 3 ILE HD1% A 13 PHE HE% 1.0 . 5.21 79 79 A 3 ILE HD1% A 13 PHE HBx 1.0 . 4.65 80 80 A 3 ILE HG2% A 13 PHE HD% 1.0 . 5.21 81 81 A 3 ILE HG2% A 13 PHE HA 1.0 . 4.65 82 82 A 3 ILE HD1% A 13 PHE HBy 1.0 . 3.69 83 83 A 14 TYR H A 3 ILE HD1% 1.0 . 4.94 84 84 A 3 ILE H A 14 TYR H 1.0 . 5.94 85 85 A 3 ILE HD1% A 45 MET HA 1.0 . 5.85 86 86 A 3 ILE HD1% A 47 GLU HA 1.0 . 0.00 87 87 A 3 ILE HD1% A 43 GLU HA 1.0 . 0.00 88 88 A 3 ILE HD1% A 47 GLU HGx 1.0 . 5.84 89 89 A 1 MET HGx A 3 ILE HD1% 1.0 . 0.00 90 90 A 3 ILE HD1% A 47 GLU HBy 1.0 . 4.59 91 91 A 3 ILE HD1% A 47 GLU HGy 1.0 . 4.04 92 92 A 3 ILE HD1% A 47 GLU HGy 1.0 . 5.21 93 93 A 3 ILE HG2% A 47 GLU HGy 1.0 . 0.00 94 94 A 3 ILE HB A 4 GLU H 1.0 . 4.48 95 95 A 3 ILE HA A 4 GLU H 1.0 . 3.50 96 96 A 3 ILE HA A 4 GLU H 1.0 . 4.14 97 97 A 3 ILE HG2% A 4 GLU H 1.0 . 4.13 98 98 A 3 ILE HG1y A 4 GLU H 1.0 . 5.21 99 99 A 3 ILE HB A 4 GLU H 1.0 . 4.55 100 100 A 4 GLU HA A 4 GLU H 1.0 . 3.60 101 101 A 4 GLU H A 4 GLU HGy 1.0 . 3.83 102 102 A 4 GLU H A 4 GLU HBy 1.0 . 0.00 103 103 A 4 GLU H A 4 GLU HGx 1.0 . 5.12 104 104 A 4 GLU H A 4 GLU HBx 1.0 . 3.79 105 105 A 4 GLU HA A 4 GLU HGy 1.0 . 3.64 106 106 A 4 GLU H A 4 GLU HBx 1.0 . 3.87 107 107 A 4 GLU HA A 4 GLU HBy 1.0 . 3.29 108 108 A 4 GLU HBy A 5 ARG HA 1.0 . 0.00 109 109 A 4 GLU HA A 4 GLU H 1.0 . 3.16 110 110 A 4 GLU HGx A 4 GLU HBx 1.0 . 3.55 111 111 A 4 GLU H A 4 GLU HGy 1.0 . 4.65 112 112 A 4 GLU HA A 4 GLU HBx 1.0 . 3.55 113 113 A 4 GLU H A 4 GLU HBy 1.0 . 3.65 114 114 A 4 GLU HA A 4 GLU HGx 1.0 . 3.75 115 115 A 4 GLU HA A 4 GLU HGy 1.0 . 3.55 116 116 A 4 GLU HA A 4 GLU HBy 1.0 . 0.00 117 117 A 4 GLU HA A 4 GLU HGx 1.0 . 3.55 118 118 A 4 GLU HA A 4 GLU HBx 1.0 . 3.42 119 119 A 4 GLU HBx A 5 ARG HA 1.0 . 0.00 120 120 A 4 GLU HBx A 5 ARG H 1.0 . 4.54 121 121 A 4 GLU HBx A 6 ILE HD1% 1.0 . 3.99 122 122 A 4 GLU HBy A 6 ILE HD1% 1.0 . 3.99 123 123 A 4 GLU H A 11 VAL HGy% 1.0 . 4.08 124 124 A 3 ILE HD1% A 4 GLU H 1.0 . 0.00 125 125 A 3 ILE HG2% A 4 GLU H 1.0 . 0.00 126 126 A 4 GLU H A 12 LYS H 1.0 . 4.37 127 127 A 4 GLU H A 12 LYS H 1.0 . 4.19 128 128 A 4 GLU HBx A 12 LYS HEx 1.0 . 4.65 129 129 A 4 GLU HBy A 12 LYS HEx 1.0 . 4.65 130 130 A 4 GLU HBy A 12 LYS H 1.0 . 4.65 131 131 A 4 GLU HBx A 12 LYS H 1.0 . 4.65 132 132 A 13 PHE HD% A 4 GLU H 1.0 . 5.05 133 133 A 13 PHE HA A 4 GLU H 1.0 . 5.07 134 134 A 13 PHE HA A 4 GLU H 1.0 . 4.11 135 135 A 13 PHE HA A 4 GLU HBx 1.0 . 5.03 136 136 A 4 GLU HGx A 5 ARG H 1.0 . 4.39 137 137 A 4 GLU HGy A 5 ARG H 1.0 . 3.84 138 138 A 4 GLU HA A 5 ARG H 1.0 . 3.53 139 139 A 5 ARG HA A 5 ARG H 1.0 . 0.00 140 140 A 4 GLU HGy A 5 ARG H 1.0 . 4.08 141 141 A 4 GLU HGx A 5 ARG H 1.0 . 3.97 142 142 A 5 ARG H A 5 ARG HBx 1.0 . 3.82 143 143 A 5 ARG H A 5 ARG HGy 1.0 . 4.72 144 144 A 5 ARG H A 5 ARG HBy 1.0 . 4.04 145 145 A 5 ARG HDx A 5 ARG HBy 1.0 . 4.34 146 146 A 5 ARG HBx A 5 ARG HGx 1.0 . 3.99 147 147 A 5 ARG HDx A 5 ARG HGx 1.0 . 4.90 148 148 A 5 ARG HA A 5 ARG HGy 1.0 . 3.80 149 149 A 5 ARG HDx A 5 ARG HA 1.0 . 4.27 150 150 A 5 ARG HA A 5 ARG HGx 1.0 . 3.74 151 151 A 5 ARG H A 5 ARG HGx 1.0 . 5.21 152 152 A 5 ARG H A 5 ARG HBx 1.0 . 4.85 153 153 A 5 ARG HDx A 5 ARG HBx 1.0 . 4.34 154 154 A 5 ARG HBx A 5 ARG HGy 1.0 . 3.92 155 155 A 5 ARG H A 5 ARG HBy 1.0 . 4.65 156 156 A 5 ARG HDx A 5 ARG HA 1.0 . 4.28 157 157 A 5 ARG HDx A 5 ARG HBx 1.0 . 4.15 158 158 A 5 ARG HDx A 5 ARG HBy 1.0 . 4.34 159 159 A 5 ARG HDx A 5 ARG HGy 1.0 . 3.65 160 160 A 5 ARG HA A 5 ARG H 1.0 . 3.14 161 161 A 5 ARG HA A 5 ARG HBy 1.0 . 3.36 162 162 A 5 ARG HDx A 5 ARG HBx 1.0 . 4.34 163 163 A 5 ARG HA A 5 ARG HBx 1.0 . 4.17 164 164 A 5 ARG HDx A 5 ARG HGy 1.0 . 3.39 165 165 A 5 ARG HDx A 5 ARG HGy 1.0 . 4.10 166 166 A 5 ARG HA A 5 ARG HBy 1.0 . 3.73 167 167 A 5 ARG HA A 5 ARG HBx 1.0 . 3.55 168 168 A 5 ARG HDx A 5 ARG HGy 1.0 . 3.63 169 169 A 5 ARG HDx A 5 ARG HBx 1.0 . 4.80 170 170 A 5 ARG HA A 5 ARG HGy 1.0 . 3.47 171 171 A 5 ARG H A 5 ARG HGy 1.0 . 4.74 172 172 A 5 ARG HDx A 5 ARG HGx 1.0 . 3.81 173 173 A 5 ARG HDx A 5 ARG HBy 1.0 . 4.34 174 174 A 5 ARG HA A 6 ILE H 1.0 . 2.86 175 175 A 6 ILE H A 7 ASN HA 1.0 . 0.00 176 176 A 5 ARG HDx A 6 ILE H 1.0 . 4.54 177 177 A 5 ARG H A 6 ILE H 1.0 . 4.69 178 178 A 5 ARG HDx A 6 ILE H 1.0 . 5.20 179 179 A 5 ARG HA A 6 ILE H 1.0 . 3.57 180 180 A 5 ARG HDx A 7 ASN H 1.0 . 4.30 181 181 A 7 ASN H A 7 ASN HBy 1.0 . 0.00 182 182 A 5 ARG HDx A 8 GLU HA 1.0 . 4.71 183 183 A 5 ARG HDx A 11 VAL HGx% 1.0 . 5.21 184 184 A 5 ARG HDx A 11 VAL HGy% 1.0 . 6.08 185 185 A 5 ARG HDx A 11 VAL HGy% 1.0 . 6.08 186 186 A 5 ARG HDx A 11 VAL HGx% 1.0 . 6.08 187 187 A 5 ARG HDx A 11 VAL HGx% 1.0 . 5.21 188 188 A 4 GLU HGy A 6 ILE HD1% 1.0 . 4.10 189 189 A 4 GLU HGy A 6 ILE HD1% 1.0 . 3.42 190 190 A 4 GLU HBy A 6 ILE HD1% 1.0 . 0.00 191 191 A 4 GLU HGx A 6 ILE HG1y 1.0 . 5.85 192 192 A 4 GLU HGx A 6 ILE HD1% 1.0 . 4.08 193 193 A 4 GLU HGy A 6 ILE HA 1.0 . 4.43 194 194 A 5 ARG HDx A 6 ILE H 1.0 . 4.41 195 195 A 5 ARG HBx A 6 ILE H 1.0 . 5.43 196 196 A 5 ARG HGy A 6 ILE H 1.0 . 5.21 197 197 A 5 ARG HA A 6 ILE HA 1.0 . 5.21 198 198 A 5 ARG HDx A 6 ILE H 1.0 . 5.54 199 199 A 5 ARG HA A 6 ILE HA 1.0 . 4.75 200 200 A 7 ASN HA A 6 ILE HA 1.0 . 0.00 201 201 A 5 ARG HA A 6 ILE HG2% 1.0 . 4.41 202 202 A 7 ASN HA A 6 ILE HG2% 1.0 . 0.00 203 203 A 5 ARG HA A 6 ILE HG1y 1.0 . 5.21 204 204 A 6 ILE H A 6 ILE HG1x 1.0 . 3.37 205 205 A 6 ILE H A 6 ILE HG2% 1.0 . 4.00 206 206 A 6 ILE H A 6 ILE HB 1.0 . 2.86 207 207 A 6 ILE H A 6 ILE HG1y 1.0 . 3.37 208 208 A 6 ILE HD1% A 6 ILE H 1.0 . 3.00 209 209 A 6 ILE H A 6 ILE HA 1.0 . 3.29 210 210 A 6 ILE HD1% A 6 ILE HB 1.0 . 3.55 211 211 A 6 ILE HD1% A 6 ILE HG2% 1.0 . 2.18 212 212 A 6 ILE HG1y A 6 ILE HA 1.0 . 3.79 213 213 A 6 ILE HD1% A 6 ILE HA 1.0 . 3.48 214 214 A 6 ILE HG2% A 6 ILE HB 1.0 . 2.99 215 215 A 6 ILE HD1% A 6 ILE HG1x 1.0 . 2.93 216 216 A 6 ILE HG1y A 6 ILE HB 1.0 . 3.37 217 217 A 6 ILE H A 6 ILE HG2% 1.0 . 3.95 218 218 A 6 ILE H A 6 ILE HG1y 1.0 . 4.67 219 219 A 6 ILE HD1% A 6 ILE HG1x 1.0 . 3.44 220 220 A 6 ILE H A 6 ILE HG1x 1.0 . 4.44 221 221 A 6 ILE HG1x A 6 ILE HB 1.0 . 3.92 222 222 A 6 ILE HG2% A 6 ILE HB 1.0 . 3.35 223 223 A 6 ILE HD1% A 6 ILE HA 1.0 . 3.28 224 224 A 6 ILE HG1y A 6 ILE HG2% 1.0 . 3.55 225 225 A 6 ILE H A 6 ILE HB 1.0 . 3.96 226 226 A 6 ILE HA A 6 ILE HG2% 1.0 . 3.23 227 227 A 6 ILE HG1x A 6 ILE HB 1.0 . 3.19 228 228 A 6 ILE HD1% A 6 ILE HB 1.0 . 3.28 229 229 A 6 ILE H A 6 ILE HA 1.0 . 4.08 230 230 A 6 ILE HA A 6 ILE HG1x 1.0 . 4.01 231 231 A 6 ILE HA A 6 ILE HB 1.0 . 4.30 232 232 A 6 ILE HA A 6 ILE HG2% 1.0 . 3.35 233 233 A 6 ILE HD1% A 6 ILE H 1.0 . 4.36 234 234 A 6 ILE HG1y A 6 ILE HA 1.0 . 4.08 235 235 A 6 ILE HG1y A 6 ILE HB 1.0 . 3.07 236 236 A 6 ILE HG1y A 6 ILE HG2% 1.0 . 3.55 237 237 A 6 ILE HD1% A 6 ILE HG1y 1.0 . 3.01 238 238 A 6 ILE HA A 6 ILE HG1x 1.0 . 3.67 239 239 A 6 ILE HG2% A 6 ILE HG1x 1.0 . 3.69 240 240 A 6 ILE HG2% A 6 ILE HG1x 1.0 . 3.55 241 241 A 6 ILE HA A 6 ILE HB 1.0 . 3.81 242 242 A 6 ILE HG2% A 7 ASN HD2x 1.0 . 4.53 243 243 A 7 ASN H A 6 ILE HG2% 1.0 . 4.72 244 244 A 6 ILE HG2% A 7 ASN HD2y 1.0 . 4.68 245 245 A 7 ASN H A 6 ILE HB 1.0 . 3.52 246 246 A 7 ASN H A 6 ILE HA 1.0 . 4.30 247 247 A 7 ASN H A 6 ILE HG2% 1.0 . 3.85 248 248 A 7 ASN H A 6 ILE HB 1.0 . 3.80 249 249 A 7 ASN HA A 6 ILE HG2% 1.0 . 5.26 250 250 A 6 ILE HG2% A 7 ASN HD2x 1.0 . 5.21 251 251 A 6 ILE HG2% A 7 ASN HD2y 1.0 . 5.21 252 252 A 7 ASN H A 6 ILE HA 1.0 . 3.94 253 253 A 6 ILE H A 9 HIS H 1.0 . 5.94 254 254 A 6 ILE HB A 10 THR H 1.0 . 4.49 255 255 A 6 ILE H A 10 THR HB 1.0 . 4.54 256 256 A 6 ILE H A 10 THR HG2% 1.0 . 4.54 257 257 A 6 ILE HG1y A 10 THR HB 1.0 . 3.92 258 258 A 6 ILE HG1x A 10 THR HB 1.0 . 6.15 259 259 A 6 ILE HD1% A 10 THR HG2% 1.0 . 3.55 260 260 A 6 ILE HB A 10 THR H 1.0 . 5.27 261 261 A 6 ILE HD1% A 10 THR HB 1.0 . 4.95 262 262 A 6 ILE HB A 10 THR HB 1.0 . 4.12 263 263 A 6 ILE HA A 10 THR HB 1.0 . 5.50 264 264 A 6 ILE HG2% A 10 THR HG2% 1.0 . 2.78 265 265 A 6 ILE H A 10 THR HB 1.0 . 4.30 266 266 A 6 ILE HB A 10 THR HG2% 1.0 . 3.24 267 267 A 6 ILE HB A 10 THR HB 1.0 . 3.59 268 268 A 6 ILE HD1% A 10 THR HA 1.0 . 4.65 269 269 A 10 THR HA A 74 ILE HG2% 1.0 . 0.00 270 270 A 11 VAL HGx% A 10 THR HA 1.0 . 0.00 271 271 A 6 ILE HG2% A 10 THR HB 1.0 . 3.88 272 272 A 6 ILE HG1y A 10 THR HG2% 1.0 . 3.08 273 273 A 10 THR HG2% A 76 THR HG2% 1.0 . 0.00 274 274 A 6 ILE HB A 10 THR HG2% 1.0 . 3.06 275 275 A 6 ILE HA A 10 THR HG2% 1.0 . 5.21 276 276 A 6 ILE H A 10 THR HG2% 1.0 . 4.65 277 277 A 6 ILE HG1y A 10 THR HB 1.0 . 5.62 278 278 A 6 ILE HG2% A 10 THR HB 1.0 . 3.56 279 279 A 6 ILE HG1x A 10 THR HB 1.0 . 3.40 280 280 A 6 ILE HD1% A 12 LYS HEx 1.0 . 3.60 281 281 A 12 LYS HEx A 74 ILE HD1% 1.0 . 0.00 282 282 A 6 ILE HD1% A 7 ASN H 1.0 . 4.72 283 283 A 6 ILE H A 7 ASN H 1.0 . 3.28 284 284 A 7 ASN HBy A 6 ILE HG2% 1.0 . 4.47 285 285 A 7 ASN H A 6 ILE HG1x 1.0 . 4.54 286 286 A 6 ILE HD1% A 7 ASN HA 1.0 . 4.66 287 287 A 5 ARG HA A 6 ILE HD1% 1.0 . 0.00 288 288 A 6 ILE HD1% A 7 ASN H 1.0 . 4.38 289 289 A 6 ILE HG2% A 7 ASN HBx 1.0 . 4.68 290 290 A 7 ASN H A 6 ILE HG1y 1.0 . 4.41 291 291 A 7 ASN HA A 6 ILE HB 1.0 . 4.96 292 292 A 7 ASN HA A 6 ILE HB 1.0 . 4.57 293 293 A 5 ARG HA A 6 ILE HB 1.0 . 0.00 294 294 A 6 ILE HG2% A 7 ASN HBx 1.0 . 4.66 295 295 A 7 ASN HBy A 6 ILE HG2% 1.0 . 4.65 296 296 A 7 ASN HA A 7 ASN H 1.0 . 3.72 297 297 A 7 ASN HBy A 7 ASN HD2x 1.0 . 4.23 298 298 A 7 ASN HBy A 7 ASN HD2y 1.0 . 4.38 299 299 A 7 ASN HD2y A 7 ASN HBx 1.0 . 4.40 300 300 A 7 ASN HA A 7 ASN HD2y 1.0 . 5.94 301 301 A 7 ASN H A 7 ASN HBx 1.0 . 4.28 302 302 A 7 ASN HD2x A 7 ASN HBx 1.0 . 4.27 303 303 A 7 ASN HBy A 7 ASN HD2x 1.0 . 5.09 304 304 A 7 ASN HBy A 7 ASN HD2y 1.0 . 4.65 305 305 A 7 ASN HA A 7 ASN HD2x 1.0 . 5.85 306 306 A 7 ASN HA A 7 ASN HBx 1.0 . 3.30 307 307 A 7 ASN HD2x A 7 ASN HBx 1.0 . 4.45 308 308 A 7 ASN HD2y A 7 ASN HBx 1.0 . 4.70 309 309 A 7 ASN H A 7 ASN HBy 1.0 . 5.24 310 310 A 7 ASN HA A 7 ASN HBy 1.0 . 3.64 311 311 A 7 ASN HA A 7 ASN HBx 1.0 . 3.78 312 312 A 7 ASN HA A 7 ASN H 1.0 . 3.73 313 313 A 7 ASN HA A 7 ASN HBy 1.0 . 3.19 314 314 A 7 ASN HA A 8 GLU H 1.0 . 4.24 315 315 A 7 ASN HBy A 8 GLU HGx 1.0 . 6.37 316 316 A 5 ARG HDx A 8 GLU HGx 1.0 . 0.00 317 317 A 9 HIS H A 7 ASN HBx 1.0 . 4.72 318 318 A 7 ASN HA A 9 HIS H 1.0 . 5.94 319 319 A 7 ASN HD2y A 9 HIS H 1.0 . 4.54 320 320 A 7 ASN HBy A 9 HIS H 1.0 . 3.88 321 321 A 9 HIS H A 9 HIS HBy 1.0 . 0.00 322 322 A 7 ASN HD2x A 9 HIS H 1.0 . 4.54 323 323 A 7 ASN HA A 9 HIS H 1.0 . 5.21 324 324 A 7 ASN H A 10 THR HG2% 1.0 . 4.95 325 325 A 7 ASN H A 10 THR H 1.0 . 4.05 326 326 A 7 ASN H A 10 THR H 1.0 . 4.30 327 327 A 7 ASN H A 10 THR HB 1.0 . 4.28 328 328 A 7 ASN H A 10 THR HG2% 1.0 . 4.65 329 329 A 7 ASN H A 10 THR HB 1.0 . 4.29 330 330 A 8 GLU H A 8 GLU HBy 1.0 . 4.83 331 331 A 8 GLU HA A 8 GLU HBx 1.0 . 3.58 332 332 A 8 GLU HA A 8 GLU HGx 1.0 . 3.55 333 333 A 8 GLU HA A 8 GLU HGy 1.0 . 4.22 334 334 A 8 GLU HA A 8 GLU HBy 1.0 . 3.55 335 335 A 8 GLU HA A 8 GLU HBy 1.0 . 3.21 336 336 A 8 GLU HA A 8 GLU HBx 1.0 . 3.05 337 337 A 8 GLU HA A 8 GLU HGx 1.0 . 3.84 338 338 A 8 GLU HA A 9 HIS H 1.0 . 4.95 339 339 A 8 GLU HA A 9 HIS H 1.0 . 4.29 340 340 A 8 GLU HBy A 9 HIS HD2 1.0 . 4.19 341 341 A 9 HIS H A 8 GLU HBx 1.0 . 4.25 342 342 A 9 HIS H A 8 GLU HBy 1.0 . 3.98 343 343 A 8 GLU HGy A 9 HIS HD2 1.0 . 5.42 344 344 A 8 GLU HGx A 9 HIS HD2 1.0 . 4.93 345 345 A 9 HIS H A 8 GLU HBx 1.0 . 4.84 346 346 A 9 HIS H A 8 GLU HGx 1.0 . 4.85 347 347 A 9 HIS H A 8 GLU HBy 1.0 . 5.27 348 348 A 9 HIS HD2 A 9 HIS HA 1.0 . 4.37 349 349 A 9 HIS HBy A 9 HIS HD2 1.0 . 4.05 350 350 A 9 HIS HD2 A 9 HIS HBx 1.0 . 4.22 351 351 A 9 HIS H A 9 HIS HBx 1.0 . 3.90 352 352 A 9 HIS H A 9 HIS HD2 1.0 . 4.76 353 353 A 9 HIS H A 9 HIS HA 1.0 . 3.96 354 354 A 9 HIS H A 9 HIS HBy 1.0 . 4.86 355 355 A 9 HIS HA A 9 HIS HBx 1.0 . 3.68 356 356 A 9 HIS HA A 9 HIS HBx 1.0 . 3.94 357 357 A 9 HIS HBy A 9 HIS HA 1.0 . 3.83 358 358 A 9 HIS H A 9 HIS HA 1.0 . 4.05 359 359 A 9 HIS HBy A 9 HIS HA 1.0 . 3.80 360 360 A 9 HIS HD2 A 9 HIS HBx 1.0 . 4.74 361 361 A 9 HIS HBy A 9 HIS HD2 1.0 . 5.13 362 362 A 9 HIS H A 9 HIS HBx 1.0 . 4.39 363 363 A 9 HIS HD2 A 55 ALA HB% 1.0 . 4.25 364 364 A 9 HIS HBx A 77 LYS HDy 1.0 . 6.37 365 365 A 6 ILE HB A 9 HIS HBx 1.0 . 0.00 366 366 A 9 HIS HBx A 77 LYS HGx 1.0 . 0.00 367 367 A 9 HIS HBy A 77 LYS HGx 1.0 . 6.37 368 368 A 6 ILE HB A 9 HIS HBy 1.0 . 0.00 369 369 A 9 HIS HBy A 77 LYS HDy 1.0 . 0.00 370 370 A 9 HIS HBx A 77 LYS HBx 1.0 . 5.53 371 371 A 9 HIS HA A 77 LYS HEy 1.0 . 4.15 372 372 A 9 HIS HA A 77 LYS HGy 1.0 . 5.21 373 373 A 77 LYS HGy A 61 TRP HA 1.0 . 0.00 374 374 A 9 HIS HA A 77 LYS HDy 1.0 . 4.92 375 375 A 9 HIS HBy A 77 LYS HBx 1.0 . 5.23 376 376 A 9 HIS HA A 77 LYS HEx 1.0 . 4.69 377 377 A 9 HIS HA A 77 LYS HEx 1.0 . 4.11 378 378 A 9 HIS HA A 77 LYS HGx 1.0 . 5.21 379 379 A 77 LYS HGx A 61 TRP HA 1.0 . 0.00 380 380 A 10 THR H A 9 HIS HBy 1.0 . 3.61 381 381 A 9 HIS H A 10 THR HB 1.0 . 4.78 382 382 A 9 HIS H A 10 THR H 1.0 . 2.76 383 383 A 9 HIS H A 10 THR HA 1.0 . 5.84 384 384 A 10 THR H A 9 HIS HA 1.0 . 3.61 385 385 A 9 HIS H A 10 THR H 1.0 . 3.45 386 386 A 10 THR H A 9 HIS HBx 1.0 . 3.61 387 387 A 10 THR H A 10 THR HG2% 1.0 . 4.29 388 388 A 10 THR H A 10 THR HB 1.0 . 3.21 389 389 A 10 THR H A 10 THR HA 1.0 . 3.37 390 390 A 10 THR HB A 10 THR HG2% 1.0 . 3.33 391 391 A 10 THR H A 10 THR HG2% 1.0 . 4.50 392 392 A 10 THR HG2% A 10 THR HA 1.0 . 3.65 393 393 A 10 THR H A 10 THR HA 1.0 . 4.88 394 394 A 10 THR HB A 10 THR HG2% 1.0 . 3.34 395 395 A 10 THR HB A 10 THR HA 1.0 . 5.23 396 396 A 10 THR H A 10 THR HB 1.0 . 4.10 397 397 A 10 THR HB A 10 THR HA 1.0 . 4.44 398 398 A 11 VAL HGx% A 10 THR H 1.0 . 5.94 399 399 A 10 THR HG2% A 74 ILE HG2% 1.0 . 3.99 400 400 A 6 ILE HD1% A 10 THR HG2% 1.0 . 0.00 401 401 A 10 THR HG2% A 74 ILE HG2% 1.0 . 2.95 402 402 A 10 THR HB A 74 ILE HG2% 1.0 . 4.65 403 403 A 6 ILE HD1% A 10 THR HB 1.0 . 0.00 404 404 A 10 THR HG2% A 74 ILE HA 1.0 . 4.14 405 405 A 10 THR HG2% A 75 VAL H 1.0 . 4.42 406 406 A 10 THR HG2% A 75 VAL H 1.0 . 5.21 407 407 A 10 THR HG2% A 76 THR HB 1.0 . 3.87 408 408 A 10 THR HG2% A 76 THR HA 1.0 . 4.73 409 409 A 10 THR HG2% A 76 THR HB 1.0 . 3.99 410 410 A 10 THR HA A 76 THR HB 1.0 . 4.11 411 411 A 76 THR HB A 76 THR HA 1.0 . 0.00 412 412 A 10 THR HA A 76 THR HG2% 1.0 . 3.56 413 413 A 76 THR HG2% A 76 THR HA 1.0 . 0.00 414 414 A 10 THR HG2% A 76 THR HA 1.0 . 3.15 415 415 A 10 THR HG2% A 10 THR HA 1.0 . 0.00 416 416 A 10 THR HA A 76 THR HG2% 1.0 . 4.56 417 417 A 10 THR HA A 77 LYS H 1.0 . 5.32 418 418 A 5 ARG HDx A 11 VAL HGy% 1.0 . 6.08 419 419 A 5 ARG HDx A 11 VAL HGy% 1.0 . 6.08 420 420 A 6 ILE H A 11 VAL HA 1.0 . 3.37 421 421 A 11 VAL HGy% A 6 ILE H 1.0 . 5.94 422 422 A 6 ILE HD1% A 11 VAL H 1.0 . 3.10 423 423 A 11 VAL HGx% A 11 VAL H 1.0 . 0.00 424 424 A 74 ILE HG2% A 11 VAL H 1.0 . 0.00 425 425 A 6 ILE HD1% A 11 VAL HA 1.0 . 4.78 426 426 A 6 ILE HD1% A 11 VAL H 1.0 . 4.56 427 427 A 5 ARG H A 6 ILE HD1% 1.0 . 0.00 428 428 A 7 ASN H A 11 VAL HA 1.0 . 5.29 429 429 A 10 THR HA A 11 VAL H 1.0 . 2.37 430 430 A 76 THR HA A 11 VAL H 1.0 . 0.00 431 431 A 10 THR HG2% A 11 VAL H 1.0 . 2.58 432 432 A 10 THR HB A 11 VAL H 1.0 . 4.05 433 433 A 10 THR H A 11 VAL H 1.0 . 4.85 434 434 A 10 THR HA A 11 VAL H 1.0 . 3.51 435 435 A 11 VAL HGy% A 10 THR HA 1.0 . 5.21 436 436 A 10 THR HG2% A 11 VAL H 1.0 . 3.35 437 437 A 10 THR HB A 11 VAL H 1.0 . 4.75 438 438 A 11 VAL HA A 11 VAL H 1.0 . 3.37 439 439 A 11 VAL H A 11 VAL HB 1.0 . 4.05 440 440 A 11 VAL HGy% A 11 VAL H 1.0 . 3.10 441 441 A 11 VAL HGy% A 11 VAL H 1.0 . 3.85 442 442 A 11 VAL HGy% A 11 VAL HA 1.0 . 4.15 443 443 A 11 VAL HGx% A 11 VAL HB 1.0 . 3.71 444 444 A 11 VAL HGy% A 11 VAL HB 1.0 . 3.36 445 445 A 11 VAL HGx% A 11 VAL H 1.0 . 4.70 446 446 A 11 VAL HA A 11 VAL HB 1.0 . 4.69 447 447 A 11 VAL H A 11 VAL HB 1.0 . 4.42 448 448 A 13 PHE HD% A 11 VAL HGy% 1.0 . 4.50 449 449 A 11 VAL HGy% A 45 MET HE% 1.0 . 4.14 450 450 A 11 VAL HGx% A 45 MET HE% 1.0 . 4.14 451 451 A 11 VAL HGy% A 75 VAL H 1.0 . 3.78 452 452 A 76 THR HA A 11 VAL H 1.0 . 4.91 453 453 A 4 GLU HBx A 12 LYS HEy 1.0 . 4.58 454 454 A 4 GLU HBy A 12 LYS HGx 1.0 . 4.39 455 455 A 4 GLU HBx A 12 LYS HEy 1.0 . 4.65 456 456 A 4 GLU HGy A 12 LYS HBy 1.0 . 6.08 457 457 A 4 GLU HGy A 12 LYS HGx 1.0 . 4.46 458 458 A 4 GLU HGy A 12 LYS H 1.0 . 4.87 459 459 A 4 GLU HBx A 12 LYS HGx 1.0 . 4.13 460 460 A 4 GLU HBx A 12 LYS HGy 1.0 . 4.14 461 461 A 4 GLU HBy A 12 LYS HEy 1.0 . 5.21 462 462 A 4 GLU HBx A 12 LYS HGx 1.0 . 4.14 463 463 A 4 GLU H A 12 LYS HGx 1.0 . 5.53 464 464 A 75 VAL H A 12 LYS HGx 1.0 . 0.00 465 465 A 4 GLU HBy A 12 LYS HEy 1.0 . 5.21 466 466 A 12 LYS H A 6 ILE H 1.0 . 3.78 467 467 A 12 LYS H A 6 ILE H 1.0 . 5.10 468 468 A 6 ILE HD1% A 12 LYS H 1.0 . 4.06 469 469 A 12 LYS H A 6 ILE HG1y 1.0 . 4.86 470 470 A 12 LYS H A 6 ILE HG1x 1.0 . 5.27 471 471 A 6 ILE HD1% A 12 LYS HEy 1.0 . 4.09 472 472 A 6 ILE HD1% A 12 LYS HBx 1.0 . 4.14 473 473 A 12 LYS H A 10 THR HG2% 1.0 . 4.45 474 474 A 12 LYS H A 10 THR HG2% 1.0 . 5.21 475 475 A 11 VAL HGy% A 12 LYS H 1.0 . 3.97 476 476 A 12 LYS H A 11 VAL HA 1.0 . 3.90 477 477 A 12 LYS H A 11 VAL HB 1.0 . 4.41 478 478 A 12 LYS H A 11 VAL HGx% 1.0 . 4.03 479 479 A 6 ILE HD1% A 12 LYS H 1.0 . 0.00 480 480 A 11 VAL HGy% A 12 LYS H 1.0 . 4.05 481 481 A 11 VAL HGx% A 12 LYS HA 1.0 . 3.60 482 482 A 74 ILE HD1% A 12 LYS HA 1.0 . 0.00 483 483 A 74 ILE HG2% A 12 LYS HA 1.0 . 0.00 484 484 A 12 LYS H A 11 VAL HGx% 1.0 . 5.23 485 485 A 12 LYS H A 11 VAL HB 1.0 . 4.33 486 486 A 12 LYS H A 12 LYS HGy 1.0 . 4.52 487 487 A 12 LYS H A 12 LYS HBy 1.0 . 3.92 488 488 A 12 LYS H A 12 LYS HA 1.0 . 5.00 489 489 A 12 LYS H A 12 LYS HBx 1.0 . 3.81 490 490 A 12 LYS H A 12 LYS HGx 1.0 . 4.45 491 491 A 12 LYS HGy A 12 LYS HA 1.0 . 5.68 492 492 A 12 LYS HEy A 12 LYS HBx 1.0 . 4.34 493 493 A 12 LYS HGx A 12 LYS HA 1.0 . 5.21 494 494 A 12 LYS HBx A 12 LYS HA 1.0 . 5.68 495 495 A 12 LYS H A 12 LYS HEy 1.0 . 6.08 496 496 A 12 LYS HGx A 12 LYS HDy 1.0 . 3.99 497 497 A 12 LYS HGx A 12 LYS HBx 1.0 . 4.14 498 498 A 12 LYS H A 12 LYS HA 1.0 . 4.32 499 499 A 12 LYS HEy A 12 LYS HBy 1.0 . 3.99 500 500 A 12 LYS HEy A 12 LYS HDy 1.0 . 0.00 501 501 A 12 LYS HEy A 12 LYS HGx 1.0 . 4.14 502 502 A 12 LYS HGy A 12 LYS HBx 1.0 . 4.14 503 503 A 12 LYS HGx A 12 LYS HBy 1.0 . 3.55 504 504 A 12 LYS HGx A 12 LYS HDy 1.0 . 0.00 505 505 A 12 LYS HEy A 12 LYS HDy 1.0 . 4.48 506 506 A 12 LYS H A 12 LYS HGx 1.0 . 5.68 507 507 A 12 LYS H A 12 LYS HGy 1.0 . 5.21 508 508 A 12 LYS H A 12 LYS HBy 1.0 . 5.06 509 509 A 12 LYS HEy A 12 LYS HBx 1.0 . 5.68 510 510 A 12 LYS HGx A 12 LYS HBx 1.0 . 4.65 511 511 A 12 LYS HEx A 12 LYS HBy 1.0 . 3.99 512 512 A 12 LYS HEx A 12 LYS HDy 1.0 . 0.00 513 513 A 12 LYS HA A 12 LYS HDy 1.0 . 5.85 514 514 A 12 LYS HGx A 12 LYS HBy 1.0 . 3.99 515 515 A 12 LYS HEy A 12 LYS HBy 1.0 . 5.85 516 516 A 12 LYS H A 12 LYS HBx 1.0 . 5.68 517 517 A 12 LYS HEy A 12 LYS HGx 1.0 . 4.65 518 518 A 12 LYS HGy A 12 LYS HDy 1.0 . 3.55 519 519 A 12 LYS HBy A 12 LYS HGy 1.0 . 0.00 520 520 A 12 LYS HEy A 12 LYS HGy 1.0 . 4.87 521 521 A 12 LYS H A 12 LYS HDy 1.0 . 6.37 522 522 A 12 LYS HBx A 12 LYS HA 1.0 . 4.04 523 523 A 12 LYS HGx A 12 LYS HA 1.0 . 3.82 524 524 A 12 LYS HEx A 12 LYS HGx 1.0 . 4.40 525 525 A 12 LYS H A 12 LYS HEx 1.0 . 6.08 526 526 A 12 LYS HGx A 12 LYS HDx 1.0 . 4.34 527 527 A 12 LYS HA A 12 LYS HDy 1.0 . 3.60 528 528 A 12 LYS HBy A 12 LYS HA 1.0 . 0.00 529 529 A 12 LYS HBy A 12 LYS HA 1.0 . 5.21 530 530 A 12 LYS HA A 13 PHE H 1.0 . 3.93 531 531 A 12 LYS HBy A 13 PHE H 1.0 . 4.64 532 532 A 13 PHE HD% A 12 LYS HA 1.0 . 5.07 533 533 A 13 PHE HA A 12 LYS HGx 1.0 . 5.41 534 534 A 13 PHE HA A 12 LYS HA 1.0 . 4.65 535 535 A 13 PHE HA A 12 LYS HGy 1.0 . 5.85 536 536 A 12 LYS HA A 13 PHE H 1.0 . 3.70 537 537 A 12 LYS HEy A 72 GLU HGy 1.0 . 5.85 538 538 A 74 ILE HA A 12 LYS HDy 1.0 . 6.08 539 539 A 74 ILE HA A 12 LYS HBx 1.0 . 6.08 540 540 A 74 ILE HG2% A 12 LYS HA 1.0 . 4.04 541 541 A 74 ILE HA A 12 LYS HA 1.0 . 3.91 542 542 A 74 ILE HG2% A 12 LYS HBy 1.0 . 4.65 543 543 A 6 ILE HD1% A 12 LYS HBy 1.0 . 0.00 544 544 A 74 ILE HD1% A 12 LYS HBy 1.0 . 0.00 545 545 A 74 ILE HA A 12 LYS HA 1.0 . 3.96 546 546 A 74 ILE HG2% A 12 LYS HBx 1.0 . 5.06 547 547 A 74 ILE HD1% A 12 LYS HBx 1.0 . 0.00 548 548 A 6 ILE HD1% A 12 LYS HBx 1.0 . 0.00 549 549 A 74 ILE HA A 12 LYS HBx 1.0 . 4.25 550 550 A 74 ILE HD1% A 12 LYS HEy 1.0 . 3.55 551 551 A 6 ILE HD1% A 12 LYS HEy 1.0 . 0.00 552 552 A 12 LYS HGx A 74 ILE HG1y 1.0 . 5.21 553 553 A 74 ILE HD1% A 12 LYS HGy 1.0 . 3.87 554 554 A 74 ILE HG2% A 12 LYS HGy 1.0 . 0.00 555 555 A 6 ILE HD1% A 12 LYS HGy 1.0 . 0.00 556 556 A 12 LYS HGy A 74 ILE HG1y 1.0 . 0.00 557 557 A 12 LYS HDy A 74 ILE HG1y 1.0 . 4.14 558 558 A 12 LYS HGx A 74 ILE HG1y 1.0 . 3.99 559 559 A 74 ILE HD1% A 12 LYS HGx 1.0 . 0.00 560 560 A 6 ILE HD1% A 12 LYS HGx 1.0 . 0.00 561 561 A 74 ILE HG2% A 12 LYS HGx 1.0 . 0.00 562 562 A 74 ILE HA A 12 LYS HBy 1.0 . 3.65 563 563 A 74 ILE HA A 74 ILE HB 1.0 . 0.00 564 564 A 74 ILE HD1% A 12 LYS HDy 1.0 . 4.14 565 565 A 74 ILE HG2% A 12 LYS HDy 1.0 . 0.00 566 566 A 6 ILE HD1% A 12 LYS HDy 1.0 . 0.00 567 567 A 74 ILE HA A 12 LYS HBy 1.0 . 5.68 568 568 A 75 VAL H A 12 LYS HA 1.0 . 4.77 569 569 A 75 VAL H A 12 LYS HBy 1.0 . 4.10 570 570 A 75 VAL H A 74 ILE HB 1.0 . 0.00 571 571 A 75 VAL H A 12 LYS HA 1.0 . 3.60 572 572 A 75 VAL H A 12 LYS HGy 1.0 . 5.21 573 573 A 4 GLU H A 12 LYS HGy 1.0 . 0.00 574 574 A 75 VAL H A 12 LYS HBy 1.0 . 5.06 575 575 A 4 GLU H A 12 LYS HBy 1.0 . 0.00 576 576 A 1 MET HE% A 13 PHE HD% 1.0 . 4.72 577 577 A 1 MET HE% A 13 PHE HD% 1.0 . 3.61 578 578 A 1 MET HE% A 13 PHE HE% 1.0 . 3.52 579 579 A 1 MET HE% A 13 PHE HBy 1.0 . 4.06 580 580 A 3 ILE HG1x A 13 PHE HE% 1.0 . 5.67 581 581 A 13 PHE HE% A 67 LEU HDy% 1.0 . 0.00 582 582 A 13 PHE HE% A 71 LEU HDx% 1.0 . 0.00 583 583 A 3 ILE HA A 13 PHE HA 1.0 . 4.26 584 584 A 3 ILE HA A 13 PHE HA 1.0 . 3.50 585 585 A 13 PHE HBy A 13 PHE HE% 1.0 . 4.62 586 586 A 13 PHE HE% A 13 PHE HZ 1.0 . 2.71 587 587 A 13 PHE HD% A 13 PHE HA 1.0 . 3.84 588 588 A 13 PHE HE% A 13 PHE HZ 1.0 . 2.11 589 589 A 13 PHE HD% A 13 PHE HE% 1.0 . 0.00 590 590 A 13 PHE HBy A 13 PHE HD% 1.0 . 3.13 591 591 A 13 PHE HBy A 13 PHE H 1.0 . 4.68 592 592 A 13 PHE H A 14 TYR HBy 1.0 . 0.00 593 593 A 13 PHE HBy A 13 PHE HD% 1.0 . 3.30 594 594 A 13 PHE HD% A 13 PHE HA 1.0 . 3.70 595 595 A 13 PHE HBx A 13 PHE HA 1.0 . 3.70 596 596 A 13 PHE HBy A 13 PHE HA 1.0 . 3.42 597 597 A 13 PHE HD% A 13 PHE HBx 1.0 . 3.57 598 598 A 14 TYR H A 13 PHE HBy 1.0 . 3.36 599 599 A 14 TYR H A 14 TYR HBy 1.0 . 0.00 600 600 A 14 TYR H A 13 PHE HA 1.0 . 3.29 601 601 A 13 PHE HA A 14 TYR HBy 1.0 . 3.14 602 602 A 13 PHE HBy A 13 PHE HA 1.0 . 0.00 603 603 A 14 TYR H A 13 PHE HBy 1.0 . 4.14 604 604 A 13 PHE HA A 14 TYR HBx 1.0 . 5.03 605 605 A 13 PHE HA A 14 TYR HBx 1.0 . 3.84 606 606 A 14 TYR HBx A 14 TYR HA 1.0 . 0.00 607 607 A 14 TYR H A 13 PHE HA 1.0 . 3.35 608 608 A 13 PHE HE% A 15 MET HBy 1.0 . 4.35 609 609 A 13 PHE HE% A 15 MET HE% 1.0 . 3.78 610 610 A 13 PHE HD% A 15 MET HE% 1.0 . 4.72 611 611 A 13 PHE HD% A 15 MET HBy 1.0 . 5.23 612 612 A 13 PHE HD% A 15 MET HGx 1.0 . 6.08 613 613 A 13 PHE HE% A 15 MET HGx 1.0 . 6.03 614 614 A 13 PHE HE% A 15 MET HE% 1.0 . 4.61 615 615 A 13 PHE HD% A 15 MET HE% 1.0 . 4.65 616 616 A 13 PHE HD% A 15 MET HBy 1.0 . 4.73 617 617 A 13 PHE HD% A 15 MET HGy 1.0 . 6.08 618 618 A 13 PHE HD% A 16 SER H 1.0 . 6.67 619 619 A 13 PHE HE% A 40 LEU HG 1.0 . 3.86 620 620 A 13 PHE HE% A 40 LEU HD21 1.0 . 3.18 621 621 A 13 PHE HE% A 30 ILE HD1% 1.0 . 0.00 622 622 A 13 PHE HE% A 73 ILE HG2% 1.0 . 0.00 623 623 A 13 PHE HE% A 73 ILE HD1% 1.0 . 0.00 624 624 A 13 PHE HE% A 40 LEU HD21 1.0 . 3.46 625 625 A 13 PHE HE% A 40 LEU HG 1.0 . 4.29 626 626 A 13 PHE HD% A 44 VAL HGx% 1.0 . 3.55 627 627 A 13 PHE HE% A 44 VAL HGy% 1.0 . 3.99 628 628 A 13 PHE HE% A 44 VAL HGx% 1.0 . 3.55 629 629 A 13 PHE HD% A 71 LEU HDx% 1.0 . 5.67 630 630 A 3 ILE HG1x A 13 PHE HD% 1.0 . 0.00 631 631 A 13 PHE HD% A 67 LEU HDy% 1.0 . 0.00 632 632 A 13 PHE H A 72 GLU HA 1.0 . 5.94 633 633 A 13 PHE H A 72 GLU HA 1.0 . 5.85 634 634 A 13 PHE HE% A 73 ILE HG1x 1.0 . 3.86 635 635 A 13 PHE HE% A 11 VAL HGy% 1.0 . 0.00 636 636 A 3 ILE HD1% A 13 PHE HE% 1.0 . 0.00 637 637 A 13 PHE HD% A 73 ILE HG2% 1.0 . 4.50 638 638 A 13 PHE HD% A 30 ILE HD1% 1.0 . 0.00 639 639 A 13 PHE HD% A 73 ILE HD1% 1.0 . 0.00 640 640 A 13 PHE HD% A 40 LEU HD21 1.0 . 0.00 641 641 A 13 PHE HD% A 73 ILE H 1.0 . 4.42 642 642 A 13 PHE HE% A 73 ILE HD1% 1.0 . 4.30 643 643 A 13 PHE HBy A 73 ILE HG2% 1.0 . 5.85 644 644 A 13 PHE HE% A 73 ILE HG2% 1.0 . 3.96 645 645 A 13 PHE HD% A 73 ILE HD1% 1.0 . 4.03 646 646 A 13 PHE HBy A 73 ILE HD1% 1.0 . 6.08 647 647 A 2 GLU HGy A 14 TYR HD% 1.0 . 4.48 648 648 A 2 GLU HBx A 14 TYR HD% 1.0 . 3.59 649 649 A 2 GLU HBy A 14 TYR HD% 1.0 . 3.26 650 650 A 2 GLU HBx A 14 TYR HBy 1.0 . 4.24 651 651 A 2 GLU HBx A 14 TYR HA 1.0 . 4.72 652 652 A 2 GLU HGy A 14 TYR HBy 1.0 . 5.21 653 653 A 2 GLU HBy A 14 TYR HBy 1.0 . 4.65 654 654 A 2 GLU HBx A 14 TYR HD% 1.0 . 4.82 655 655 A 2 GLU HBy A 14 TYR HBy 1.0 . 4.55 656 656 A 2 GLU HBy A 14 TYR HD% 1.0 . 4.38 657 657 A 2 GLU HBy A 14 TYR HBx 1.0 . 4.53 658 658 A 2 GLU HBy A 14 TYR HBx 1.0 . 4.65 659 659 A 2 GLU HBx A 14 TYR HBx 1.0 . 4.65 660 660 A 2 GLU HBy A 14 TYR HA 1.0 . 5.37 661 661 A 2 GLU HBx A 14 TYR HBy 1.0 . 4.97 662 662 A 2 GLU HGy A 14 TYR HD% 1.0 . 5.21 663 663 A 2 GLU HBx A 14 TYR HBx 1.0 . 5.00 664 664 A 2 GLU HGy A 14 TYR HBy 1.0 . 6.22 665 665 A 2 GLU HBy A 14 TYR HA 1.0 . 5.21 666 666 A 13 PHE HD% A 14 TYR HA 1.0 . 4.14 667 667 A 14 TYR H A 13 PHE HBx 1.0 . 4.09 668 668 A 14 TYR H A 14 TYR HD% 1.0 . 3.99 669 669 A 14 TYR HBy A 14 TYR HD% 1.0 . 3.21 670 670 A 14 TYR HA A 14 TYR HE% 1.0 . 4.78 671 671 A 14 TYR HD% A 14 TYR HE% 1.0 . 2.56 672 672 A 14 TYR HD% A 14 TYR HE% 1.0 . 2.70 673 673 A 14 TYR HA A 14 TYR HD% 1.0 . 3.46 674 674 A 14 TYR HBx A 14 TYR HD% 1.0 . 3.24 675 675 A 14 TYR HBx A 14 TYR HE% 1.0 . 4.51 676 676 A 14 TYR H A 14 TYR HBx 1.0 . 3.88 677 677 A 14 TYR H A 14 TYR HA 1.0 . 3.27 678 678 A 14 TYR H A 14 TYR HD% 1.0 . 3.98 679 679 A 14 TYR HBx A 14 TYR HD% 1.0 . 3.68 680 680 A 14 TYR HBy A 14 TYR HA 1.0 . 3.38 681 681 A 13 PHE HA A 14 TYR HBy 1.0 . 0.00 682 682 A 14 TYR HA A 14 TYR HE% 1.0 . 5.21 683 683 A 14 TYR HBx A 14 TYR HE% 1.0 . 4.62 684 684 A 14 TYR HBy A 14 TYR HE% 1.0 . 5.13 685 685 A 14 TYR H A 14 TYR HA 1.0 . 3.17 686 686 A 14 TYR HA A 14 TYR HD% 1.0 . 2.88 687 687 A 14 TYR H A 14 TYR HBx 1.0 . 4.34 688 688 A 14 TYR H A 14 TYR HBy 1.0 . 3.52 689 689 A 14 TYR HBy A 14 TYR HA 1.0 . 3.05 690 690 A 14 TYR HBy A 14 TYR HD% 1.0 . 3.48 691 691 A 14 TYR HBx A 14 TYR HA 1.0 . 3.05 692 692 A 14 TYR HD% A 15 MET H 1.0 . 4.35 693 693 A 14 TYR HBy A 15 MET H 1.0 . 4.96 694 694 A 14 TYR HA A 15 MET H 1.0 . 2.76 695 695 A 14 TYR HBx A 15 MET H 1.0 . 5.49 696 696 A 14 TYR HD% A 15 MET H 1.0 . 3.37 697 697 A 14 TYR HBx A 15 MET H 1.0 . 4.76 698 698 A 14 TYR HA A 15 MET HA 1.0 . 4.52 699 699 A 14 TYR HA A 15 MET HBy 1.0 . 4.95 700 700 A 14 TYR HA A 15 MET H 1.0 . 2.72 701 701 A 14 TYR HE% A 16 SER HBy 1.0 . 4.08 702 702 A 14 TYR HE% A 16 SER HBx 1.0 . 5.33 703 703 A 16 SER H A 14 TYR HD% 1.0 . 5.29 704 704 A 14 TYR HE% A 16 SER HBx 1.0 . 4.48 705 705 A 67 LEU HDy% A 14 TYR HA 1.0 . 5.21 706 706 A 71 LEU HDx% A 14 TYR HA 1.0 . 0.00 707 707 A 71 LEU HDx% A 14 TYR HE% 1.0 . 3.86 708 708 A 67 LEU HDy% A 14 TYR HE% 1.0 . 0.00 709 709 A 71 LEU HDx% A 14 TYR HD% 1.0 . 4.33 710 710 A 67 LEU HDy% A 14 TYR HD% 1.0 . 0.00 711 711 A 72 GLU HA A 14 TYR HE% 1.0 . 4.70 712 712 A 14 TYR HD% A 72 GLU HGx 1.0 . 3.40 713 713 A 72 GLU HGy A 14 TYR HD% 1.0 . 3.37 714 714 A 72 GLU HA A 14 TYR HD% 1.0 . 4.03 715 715 A 72 GLU HGy A 14 TYR HBx 1.0 . 4.84 716 716 A 72 GLU HGy A 14 TYR HD% 1.0 . 4.61 717 717 A 14 TYR HBy A 72 GLU HBx 1.0 . 3.82 718 718 A 14 TYR HBy A 72 GLU HGx 1.0 . 0.00 719 719 A 14 TYR HD% A 72 GLU HBy 1.0 . 4.77 720 720 A 14 TYR HA A 72 GLU HGx 1.0 . 3.90 721 721 A 14 TYR HA A 72 GLU H 1.0 . 3.67 722 722 A 14 TYR HA A 73 ILE H 1.0 . 0.00 723 723 A 14 TYR HD% A 72 GLU HGx 1.0 . 4.81 724 724 A 72 GLU HGy A 14 TYR HA 1.0 . 4.69 725 725 A 14 TYR HA A 72 GLU HBx 1.0 . 4.80 726 726 A 14 TYR HA A 72 GLU HA 1.0 . 2.96 727 727 A 72 GLU HGy A 14 TYR HA 1.0 . 4.09 728 728 A 14 TYR HA A 72 GLU HA 1.0 . 4.00 729 729 A 14 TYR HBx A 72 GLU HBx 1.0 . 5.21 730 730 A 14 TYR HBx A 72 GLU HGx 1.0 . 0.00 731 731 A 14 TYR HA A 72 GLU HBy 1.0 . 5.22 732 732 A 14 TYR HA A 72 GLU HGx 1.0 . 4.82 733 733 A 14 TYR HD% A 72 GLU HBx 1.0 . 5.27 734 734 A 14 TYR HA A 73 ILE H 1.0 . 3.61 735 735 A 1 MET HE% A 15 MET H 1.0 . 5.00 736 736 A 14 TYR H A 15 MET H 1.0 . 4.77 737 737 A 15 MET H A 15 MET HA 1.0 . 3.93 738 738 A 15 MET H A 15 MET HBx 1.0 . 3.37 739 739 A 15 MET H A 15 MET HBx 1.0 . 5.33 740 740 A 15 MET HGx A 15 MET HBx 1.0 . 2.88 741 741 A 15 MET HBy A 15 MET HGx 1.0 . 4.20 742 742 A 15 MET HBy A 15 MET HA 1.0 . 3.99 743 743 A 15 MET HGx A 15 MET HBx 1.0 . 4.06 744 744 A 15 MET HBy A 15 MET HGx 1.0 . 2.88 745 745 A 15 MET HBy A 15 MET H 1.0 . 5.09 746 746 A 15 MET HGy A 15 MET HBx 1.0 . 2.88 747 747 A 15 MET HA A 15 MET HBx 1.0 . 4.35 748 748 A 15 MET HBy A 15 MET HGy 1.0 . 2.88 749 749 A 15 MET H A 15 MET HA 1.0 . 5.15 750 750 A 15 MET HGx A 15 MET HA 1.0 . 4.32 751 751 A 15 MET HE% A 15 MET H 1.0 . 5.85 752 752 A 15 MET HE% A 15 MET HGx 1.0 . 4.14 753 753 A 15 MET HGx A 15 MET HA 1.0 . 3.55 754 754 A 15 MET HGx A 16 SER HA 1.0 . 0.00 755 755 A 15 MET HE% A 15 MET HA 1.0 . 4.00 756 756 A 15 MET HA A 15 MET HBx 1.0 . 0.00 757 757 A 15 MET HGx A 16 SER H 1.0 . 4.04 758 758 A 15 MET HBy A 16 SER H 1.0 . 4.54 759 759 A 15 MET HGx A 16 SER H 1.0 . 5.85 760 760 A 15 MET HBy A 16 SER H 1.0 . 4.21 761 761 A 16 SER H A 15 MET HBx 1.0 . 5.72 762 762 A 72 GLU HA A 15 MET H 1.0 . 3.61 763 763 A 73 ILE HD1% A 15 MET HBx 1.0 . 4.22 764 764 A 15 MET HE% A 73 ILE HD1% 1.0 . 0.00 765 765 A 1 MET HBx A 16 SER H 1.0 . 4.88 766 766 A 1 MET HBy A 16 SER H 1.0 . 5.05 767 767 A 2 GLU HBx A 16 SER HBy 1.0 . 5.85 768 768 A 1 MET HBy A 16 SER HBy 1.0 . 0.00 769 769 A 16 SER HBy A 70 GLY HAx 1.0 . 0.00 770 770 A 14 TYR HE% A 16 SER HA 1.0 . 4.08 771 771 A 14 TYR HD% A 16 SER HBy 1.0 . 5.67 772 772 A 14 TYR HD% A 16 SER HA 1.0 . 0.00 773 773 A 1 MET HA A 14 TYR HD% 1.0 . 0.00 774 774 A 14 TYR HE% A 16 SER HA 1.0 . 5.00 775 775 A 15 MET HE% A 16 SER H 1.0 . 4.54 776 776 A 16 SER H A 15 MET HBx 1.0 . 0.00 777 777 A 16 SER H A 15 MET H 1.0 . 4.61 778 778 A 16 SER H A 15 MET H 1.0 . 5.15 779 779 A 15 MET HGy A 16 SER HA 1.0 . 3.55 780 780 A 15 MET HGy A 15 MET HA 1.0 . 0.00 781 781 A 15 MET HBy A 16 SER HA 1.0 . 4.43 782 782 A 15 MET HBy A 15 MET HA 1.0 . 0.00 783 783 A 16 SER H A 15 MET HA 1.0 . 3.81 784 784 A 15 MET HE% A 16 SER H 1.0 . 5.85 785 785 A 15 MET HA A 16 SER HBx 1.0 . 5.11 786 786 A 16 SER H A 16 SER HBx 1.0 . 3.89 787 787 A 16 SER H A 16 SER HA 1.0 . 2.98 788 788 A 16 SER H A 16 SER HBy 1.0 . 0.00 789 789 A 16 SER H A 16 SER HBy 1.0 . 4.16 790 790 A 16 SER HBx A 16 SER HA 1.0 . 3.31 791 791 A 16 SER H A 16 SER HBx 1.0 . 3.93 792 792 A 16 SER H A 16 SER HA 1.0 . 4.92 793 793 A 16 SER HA A 17 TYR H 1.0 . 3.23 794 794 A 17 TYR H A 17 TYR HA 1.0 . 0.00 795 795 A 16 SER HBy A 17 TYR H 1.0 . 0.00 796 796 A 16 SER HA A 17 TYR HBx 1.0 . 5.85 797 797 A 16 SER HA A 17 TYR H 1.0 . 3.90 798 798 A 16 SER HA A 70 GLY H 1.0 . 4.58 799 799 A 17 TYR HA A 70 GLY H 1.0 . 0.00 800 800 A 16 SER HA A 70 GLY HAx 1.0 . 3.73 801 801 A 16 SER HA A 70 GLY HAy 1.0 . 3.69 802 802 A 16 SER HA A 70 GLY HAx 1.0 . 3.28 803 803 A 16 SER HA A 70 GLY HAy 1.0 . 3.33 804 804 A 71 LEU HDx% A 16 SER HA 1.0 . 4.81 805 805 A 71 LEU HDx% A 16 SER HA 1.0 . 5.21 806 806 A 16 SER H A 17 TYR H 1.0 . 5.55 807 807 A 16 SER HBx A 17 TYR H 1.0 . 4.02 808 808 A 16 SER H A 17 TYR H 1.0 . 5.68 809 809 A 16 SER HBy A 17 TYR H 1.0 . 4.28 810 810 A 16 SER HA A 17 TYR HD% 1.0 . 4.87 811 811 A 16 SER HBx A 17 TYR H 1.0 . 4.04 812 812 A 17 TYR HA A 17 TYR HE% 1.0 . 4.33 813 813 A 17 TYR HD% A 17 TYR HBy 1.0 . 3.22 814 814 A 17 TYR H A 17 TYR HE% 1.0 . 4.68 815 815 A 17 TYR HD% A 17 TYR HE% 1.0 . 2.62 816 816 A 17 TYR HE% A 17 TYR HBy 1.0 . 4.72 817 817 A 17 TYR H A 17 TYR HD% 1.0 . 4.07 818 818 A 17 TYR HBx A 17 TYR HD% 1.0 . 3.44 819 819 A 17 TYR HD% A 17 TYR HE% 1.0 . 2.76 820 820 A 17 TYR HA A 17 TYR HD% 1.0 . 3.07 821 821 A 17 TYR HBx A 17 TYR HE% 1.0 . 5.19 822 822 A 17 TYR H A 17 TYR HE% 1.0 . 5.07 823 823 A 17 TYR H A 17 TYR HD% 1.0 . 3.92 824 824 A 17 TYR H A 17 TYR HBy 1.0 . 3.94 825 825 A 17 TYR H A 17 TYR HBx 1.0 . 4.08 826 826 A 17 TYR HBx A 17 TYR HD% 1.0 . 3.64 827 827 A 17 TYR H A 17 TYR HBx 1.0 . 4.36 828 828 A 17 TYR HA A 17 TYR HE% 1.0 . 4.41 829 829 A 17 TYR HA A 17 TYR HBy 1.0 . 3.94 830 830 A 17 TYR HA A 17 TYR HBx 1.0 . 3.84 831 831 A 17 TYR HA A 17 TYR HBx 1.0 . 4.49 832 832 A 17 TYR HE% A 17 TYR HBy 1.0 . 5.21 833 833 A 17 TYR HD% A 17 TYR HBy 1.0 . 3.57 834 834 A 17 TYR HBx A 17 TYR HE% 1.0 . 4.52 835 835 A 17 TYR HA A 17 TYR HD% 1.0 . 3.53 836 836 A 17 TYR H A 17 TYR HBy 1.0 . 4.17 837 837 A 17 TYR HA A 17 TYR HBy 1.0 . 4.01 838 838 A 17 TYR H A 17 TYR HA 1.0 . 5.56 839 839 A 17 TYR HA A 18 GLY HAy 1.0 . 5.21 840 840 A 17 TYR HBx A 18 GLY HAy 1.0 . 6.37 841 841 A 17 TYR HD% A 20 ILE HB 1.0 . 3.97 842 842 A 17 TYR HD% A 69 LYS HBy 1.0 . 0.00 843 843 A 17 TYR HA A 20 ILE H 1.0 . 3.95 844 844 A 20 ILE H A 19 ASP HA 1.0 . 0.00 845 845 A 17 TYR HD% A 20 ILE HD1% 1.0 . 3.54 846 846 A 17 TYR HA A 20 ILE HB 1.0 . 4.05 847 847 A 17 TYR HA A 20 ILE HA 1.0 . 5.85 848 848 A 17 TYR HA A 20 ILE HD1% 1.0 . 3.70 849 849 A 17 TYR HA A 20 ILE HD1% 1.0 . 3.42 850 850 A 17 TYR HA A 20 ILE H 1.0 . 4.72 851 851 A 17 TYR HD% A 20 ILE HG2% 1.0 . 5.21 852 852 A 17 TYR HD% A 20 ILE HB 1.0 . 4.51 853 853 A 17 TYR HBy A 20 ILE HD1% 1.0 . 5.68 854 854 A 17 TYR HA A 20 ILE HB 1.0 . 4.24 855 855 A 17 TYR HE% A 20 ILE HD1% 1.0 . 4.65 856 856 A 17 TYR HE% A 27 ARG HDy 1.0 . 5.02 857 857 A 17 TYR HA A 27 ARG HBx 1.0 . 5.21 858 858 A 17 TYR HA A 20 ILE HG1y 1.0 . 0.00 859 859 A 17 TYR HD% A 27 ARG HDy 1.0 . 4.76 860 860 A 17 TYR HE% A 66 ALA HB% 1.0 . 4.05 861 861 A 67 LEU HDy% A 17 TYR HE% 1.0 . 5.21 862 862 A 67 LEU HDy% A 14 TYR HD% 1.0 . 0.00 863 863 A 17 TYR HE% A 68 ASP HA 1.0 . 5.05 864 864 A 17 TYR HE% A 68 ASP HA 1.0 . 6.37 865 865 A 17 TYR HD% A 68 ASP HA 1.0 . 5.85 866 866 A 70 GLY H A 68 ASP HA 1.0 . 0.00 867 867 A 17 TYR HD% A 69 LYS HGx 1.0 . 5.67 868 868 A 17 TYR HE% A 69 LYS HA 1.0 . 3.63 869 869 A 17 TYR HE% A 69 LYS HBy 1.0 . 4.98 870 870 A 17 TYR HD% A 69 LYS HDx 1.0 . 4.50 871 871 A 17 TYR HD% A 69 LYS HA 1.0 . 3.43 872 872 A 17 TYR HE% A 69 LYS HDx 1.0 . 4.01 873 873 A 17 TYR H A 69 LYS HBx 1.0 . 5.94 874 874 A 17 TYR HD% A 69 LYS HA 1.0 . 3.45 875 875 A 70 GLY H A 69 LYS HA 1.0 . 0.00 876 876 A 17 TYR HD% A 69 LYS HGx 1.0 . 5.85 877 877 A 70 GLY H A 69 LYS HGx 1.0 . 0.00 878 878 A 17 TYR HE% A 69 LYS HA 1.0 . 3.90 879 879 A 17 TYR HD% A 69 LYS HBx 1.0 . 4.84 880 880 A 70 GLY H A 69 LYS HBx 1.0 . 0.00 881 881 A 17 TYR HBx A 69 LYS HA 1.0 . 5.48 882 882 A 17 TYR HD% A 69 LYS HGy 1.0 . 5.85 883 883 A 70 GLY H A 69 LYS HGy 1.0 . 0.00 884 884 A 17 TYR HD% A 69 LYS HBy 1.0 . 4.41 885 885 A 70 GLY H A 69 LYS HBy 1.0 . 0.00 886 886 A 17 TYR HE% A 69 LYS HBy 1.0 . 5.10 887 887 A 70 GLY HAy A 17 TYR HE% 1.0 . 4.98 888 888 A 70 GLY HAy A 17 TYR HD% 1.0 . 4.45 889 889 A 70 GLY HAx A 17 TYR H 1.0 . 3.56 890 890 A 70 GLY H A 17 TYR HE% 1.0 . 3.94 891 891 A 17 TYR H A 70 GLY HAy 1.0 . 3.95 892 892 A 70 GLY HAx A 17 TYR HE% 1.0 . 4.73 893 893 A 70 GLY HAx A 17 TYR H 1.0 . 3.95 894 894 A 17 TYR H A 70 GLY HAy 1.0 . 4.34 895 895 A 71 LEU HDx% A 17 TYR HD% 1.0 . 3.53 896 896 A 17 TYR HD% A 20 ILE HG2% 1.0 . 0.00 897 897 A 71 LEU HDx% A 17 TYR HD% 1.0 . 3.13 898 898 A 17 TYR HD% A 20 ILE HD1% 1.0 . 0.00 899 899 A 17 TYR HE% A 71 LEU HG 1.0 . 4.33 900 900 A 17 TYR HE% A 69 LYS HGx 1.0 . 0.00 901 901 A 71 LEU HDx% A 17 TYR HE% 1.0 . 3.30 902 902 A 17 TYR HE% A 20 ILE HD1% 1.0 . 0.00 903 903 A 71 LEU HDx% A 17 TYR HE% 1.0 . 3.23 904 904 A 67 LEU HDy% A 17 TYR HE% 1.0 . 0.00 905 905 A 17 TYR H A 71 LEU H 1.0 . 4.95 906 906 A 17 TYR H A 71 LEU H 1.0 . 4.73 907 907 A 71 LEU HDx% A 17 TYR H 1.0 . 4.98 908 908 A 71 LEU HDx% A 17 TYR HE% 1.0 . 4.55 909 909 A 71 LEU HDx% A 17 TYR HD% 1.0 . 4.40 910 910 A 71 LEU HDx% A 70 GLY H 1.0 . 0.00 911 911 A 71 LEU HDx% A 17 TYR HE% 1.0 . 5.21 912 912 A 71 LEU HDx% A 14 TYR HD% 1.0 . 0.00 913 913 A 17 TYR HE% A 71 LEU HG 1.0 . 5.07 914 914 A 18 GLY HAy A 18 GLY H 1.0 . 4.05 915 915 A 18 GLY HAy A 18 GLY H 1.0 . 3.87 916 916 A 18 GLY HAy A 19 ASP H 1.0 . 3.80 917 917 A 18 GLY HAy A 19 ASP H 1.0 . 4.87 918 918 A 18 GLY HAy A 19 ASP HA 1.0 . 5.21 919 919 A 18 GLY HAy A 21 GLU H 1.0 . 5.62 920 920 A 18 GLY HAy A 21 GLU HGx 1.0 . 5.21 921 921 A 18 GLY HAy A 21 GLU HGy 1.0 . 5.21 922 922 A 18 GLY HAy A 21 GLU HGx 1.0 . 5.06 923 923 A 18 GLY HAy A 21 GLU HBx 1.0 . 5.21 924 924 A 18 GLY HAy A 21 GLU H 1.0 . 5.68 925 925 A 18 GLY HAy A 21 GLU HBy 1.0 . 5.21 926 926 A 18 GLY HAy A 21 GLU HBx 1.0 . 5.21 927 927 A 18 GLY HAy A 21 GLU HBy 1.0 . 5.21 928 928 A 18 GLY HAy A 22 ASP H 1.0 . 4.77 929 929 A 18 GLY HAy A 22 ASP H 1.0 . 6.37 930 930 A 15 MET HE% A 19 ASP H 1.0 . 5.29 931 931 A 15 MET HE% A 19 ASP HBy 1.0 . 3.87 932 932 A 15 MET HE% A 19 ASP H 1.0 . 5.47 933 933 A 15 MET HE% A 20 ILE H 1.0 . 0.00 934 934 A 15 MET HGx A 19 ASP HBy 1.0 . 4.34 935 935 A 15 MET HE% A 19 ASP HBx 1.0 . 3.75 936 936 A 15 MET HGy A 19 ASP HBy 1.0 . 4.34 937 937 A 15 MET HE% A 19 ASP HBx 1.0 . 4.87 938 938 A 15 MET HE% A 19 ASP HBy 1.0 . 4.34 939 939 A 15 MET HE% A 22 ASP HBx 1.0 . 0.00 940 940 A 15 MET HGy A 19 ASP HBx 1.0 . 4.34 941 941 A 15 MET HE% A 19 ASP HA 1.0 . 5.06 942 942 A 15 MET HE% A 15 MET HA 1.0 . 0.00 943 943 A 15 MET HGx A 19 ASP HBx 1.0 . 4.34 944 944 A 16 SER H A 19 ASP H 1.0 . 4.92 945 945 A 16 SER H A 19 ASP HBy 1.0 . 4.19 946 946 A 16 SER H A 19 ASP H 1.0 . 4.72 947 947 A 16 SER H A 19 ASP HBx 1.0 . 3.89 948 948 A 16 SER HBx A 19 ASP HBy 1.0 . 4.96 949 949 A 16 SER H A 19 ASP HBx 1.0 . 4.45 950 950 A 16 SER H A 19 ASP HBy 1.0 . 5.74 951 951 A 16 SER HBx A 19 ASP HBx 1.0 . 5.67 952 952 A 19 ASP H A 19 ASP HBx 1.0 . 3.64 953 953 A 19 ASP HA A 19 ASP H 1.0 . 3.68 954 954 A 19 ASP H A 19 ASP HBy 1.0 . 3.66 955 955 A 19 ASP H A 19 ASP HBx 1.0 . 3.89 956 956 A 19 ASP H A 19 ASP HBy 1.0 . 3.52 957 957 A 19 ASP HA A 19 ASP HBy 1.0 . 3.17 958 958 A 19 ASP HA A 19 ASP HBx 1.0 . 3.17 959 959 A 19 ASP HA A 19 ASP HBy 1.0 . 3.55 960 960 A 19 ASP HA A 19 ASP HBx 1.0 . 3.51 961 961 A 19 ASP HA A 19 ASP H 1.0 . 3.32 962 962 A 20 ILE H A 19 ASP HBy 1.0 . 4.05 963 963 A 19 ASP H A 21 GLU HBx 1.0 . 5.94 964 964 A 20 ILE HB A 19 ASP H 1.0 . 0.00 965 965 A 19 ASP HA A 21 GLU HBx 1.0 . 5.85 966 966 A 20 ILE HB A 19 ASP HA 1.0 . 0.00 967 967 A 19 ASP HA A 22 ASP H 1.0 . 4.75 968 968 A 19 ASP HA A 22 ASP HBy 1.0 . 3.55 969 969 A 15 MET HE% A 20 ILE HA 1.0 . 3.66 970 970 A 20 ILE HA A 20 ILE HG1y 1.0 . 0.00 971 971 A 15 MET HGy A 20 ILE HB 1.0 . 5.21 972 972 A 15 MET HE% A 20 ILE HA 1.0 . 5.68 973 973 A 15 MET HBx A 20 ILE HD1% 1.0 . 3.78 974 974 A 71 LEU HDx% A 15 MET HBx 1.0 . 0.00 975 975 A 15 MET HGy A 20 ILE HD1% 1.0 . 3.55 976 976 A 15 MET HGx A 20 ILE HD1% 1.0 . 3.55 977 977 A 16 SER H A 20 ILE HD1% 1.0 . 4.77 978 978 A 20 ILE HG1y A 19 ASP H 1.0 . 4.51 979 979 A 20 ILE HG1y A 19 ASP H 1.0 . 4.47 980 980 A 20 ILE H A 20 ILE HG1y 1.0 . 0.00 981 981 A 20 ILE H A 20 ILE HG1x 1.0 . 3.95 982 982 A 20 ILE H A 20 ILE HA 1.0 . 4.42 983 983 A 20 ILE H A 20 ILE HD1% 1.0 . 3.79 984 984 A 20 ILE HB A 20 ILE H 1.0 . 4.05 985 985 A 20 ILE H A 21 GLU HBx 1.0 . 0.00 986 986 A 20 ILE H A 20 ILE HG2% 1.0 . 3.73 987 987 A 20 ILE H A 20 ILE HG1y 1.0 . 4.05 988 988 A 20 ILE HA A 20 ILE HG1y 1.0 . 4.03 989 989 A 20 ILE HB A 20 ILE H 1.0 . 3.80 990 990 A 20 ILE HA A 20 ILE HG1x 1.0 . 4.81 991 991 A 20 ILE HB A 20 ILE HD1% 1.0 . 3.13 992 992 A 20 ILE H A 20 ILE HG2% 1.0 . 4.72 993 993 A 20 ILE HD1% A 20 ILE HG1y 1.0 . 2.79 994 994 A 20 ILE HD1% A 20 ILE HG1x 1.0 . 3.41 995 995 A 20 ILE HA A 20 ILE HG1x 1.0 . 3.56 996 996 A 20 ILE HD1% A 20 ILE HG1y 1.0 . 3.31 997 997 A 20 ILE HG2% A 20 ILE HG1x 1.0 . 3.31 998 998 A 20 ILE HA A 20 ILE HG2% 1.0 . 3.48 999 999 A 20 ILE HB A 20 ILE HG2% 1.0 . 3.14 1000 1000 A 20 ILE H A 20 ILE HD1% 1.0 . 4.48 1001 1001 A 20 ILE HD1% A 19 ASP H 1.0 . 0.00 1002 1002 A 20 ILE HB A 20 ILE HD1% 1.0 . 3.23 1003 1003 A 20 ILE HB A 20 ILE HA 1.0 . 4.26 1004 1004 A 20 ILE H A 20 ILE HA 1.0 . 4.08 1005 1005 A 20 ILE HA A 19 ASP H 1.0 . 0.00 1006 1006 A 20 ILE HD1% A 20 ILE HA 1.0 . 4.20 1007 1007 A 20 ILE HG2% A 20 ILE HG1y 1.0 . 3.30 1008 1008 A 20 ILE HB A 20 ILE HG1y 1.0 . 3.58 1009 1009 A 20 ILE H A 20 ILE HG1x 1.0 . 5.08 1010 1010 A 20 ILE HB A 20 ILE HG1x 1.0 . 4.01 1011 1011 A 20 ILE HG1y A 21 GLU H 1.0 . 4.42 1012 1012 A 20 ILE HG2% A 21 GLU H 1.0 . 4.49 1013 1013 A 20 ILE HD1% A 21 GLU H 1.0 . 5.94 1014 1014 A 20 ILE HA A 21 GLU HA 1.0 . 4.97 1015 1015 A 20 ILE HB A 21 GLU H 1.0 . 4.56 1016 1016 A 20 ILE HA A 21 GLU HBx 1.0 . 4.29 1017 1017 A 20 ILE HB A 20 ILE HA 1.0 . 0.00 1018 1018 A 20 ILE HA A 21 GLU H 1.0 . 4.52 1019 1019 A 20 ILE HA A 23 ARG H 1.0 . 4.25 1020 1020 A 20 ILE HA A 23 ARG H 1.0 . 4.55 1021 1021 A 20 ILE HG2% A 25 PHE HBx 1.0 . 3.62 1022 1022 A 20 ILE HD1% A 25 PHE HBy 1.0 . 5.21 1023 1023 A 20 ILE HD1% A 19 ASP HBy 1.0 . 0.00 1024 1024 A 20 ILE HG2% A 25 PHE HBy 1.0 . 3.84 1025 1025 A 20 ILE HG2% A 30 ILE HG2% 1.0 . 3.55 1026 1026 A 71 LEU HDx% A 30 ILE HG2% 1.0 . 0.00 1027 1027 A 30 ILE HD1% A 20 ILE HB 1.0 . 5.68 1028 1028 A 40 LEU HD21 A 20 ILE HB 1.0 . 0.00 1029 1029 A 30 ILE HD1% A 20 ILE HG2% 1.0 . 3.26 1030 1030 A 20 ILE HD1% A 31 TRP HE1 1.0 . 4.55 1031 1031 A 71 LEU HDx% A 31 TRP HE1 1.0 . 0.00 1032 1032 A 20 ILE H A 21 GLU H 1.0 . 5.01 1033 1033 A 20 ILE H A 21 GLU H 1.0 . 3.58 1034 1034 A 20 ILE HG2% A 21 GLU HGx 1.0 . 5.85 1035 1035 A 20 ILE HG2% A 21 GLU HA 1.0 . 4.51 1036 1036 A 20 ILE HG2% A 21 GLU HA 1.0 . 3.41 1037 1037 A 20 ILE HG2% A 25 PHE HA 1.0 . 0.00 1038 1038 A 20 ILE HG2% A 21 GLU HGy 1.0 . 5.85 1039 1039 A 21 GLU H A 21 GLU HGy 1.0 . 4.07 1040 1040 A 21 GLU H A 21 GLU HBy 1.0 . 3.60 1041 1041 A 21 GLU H A 21 GLU HBx 1.0 . 3.46 1042 1042 A 21 GLU H A 21 GLU HA 1.0 . 4.39 1043 1043 A 21 GLU H A 21 GLU HA 1.0 . 3.87 1044 1044 A 21 GLU HBx A 21 GLU HA 1.0 . 3.46 1045 1045 A 21 GLU H A 21 GLU HBx 1.0 . 3.77 1046 1046 A 21 GLU HBy A 21 GLU HA 1.0 . 3.68 1047 1047 A 21 GLU HGy A 21 GLU HA 1.0 . 3.99 1048 1048 A 21 GLU HBy A 21 GLU HA 1.0 . 3.58 1049 1049 A 21 GLU HGy A 21 GLU HBy 1.0 . 3.99 1050 1050 A 21 GLU HGx A 21 GLU HA 1.0 . 3.56 1051 1051 A 21 GLU HGy A 21 GLU HBx 1.0 . 3.55 1052 1052 A 21 GLU H A 21 GLU HGy 1.0 . 3.85 1053 1053 A 21 GLU HBx A 21 GLU HA 1.0 . 3.26 1054 1054 A 21 GLU HGy A 21 GLU HA 1.0 . 3.54 1055 1055 A 21 GLU H A 21 GLU HBy 1.0 . 3.67 1056 1056 A 21 GLU HGx A 21 GLU HA 1.0 . 3.99 1057 1057 A 21 GLU H A 21 GLU HGx 1.0 . 4.04 1058 1058 A 21 GLU HBx A 22 ASP H 1.0 . 4.05 1059 1059 A 21 GLU HBy A 22 ASP H 1.0 . 4.05 1060 1060 A 21 GLU HGy A 22 ASP H 1.0 . 4.54 1061 1061 A 21 GLU HBx A 22 ASP H 1.0 . 4.63 1062 1062 A 22 ASP H A 21 GLU HA 1.0 . 5.53 1063 1063 A 21 GLU HGx A 22 ASP H 1.0 . 5.20 1064 1064 A 21 GLU HGy A 22 ASP H 1.0 . 5.22 1065 1065 A 21 GLU HBx A 22 ASP HA 1.0 . 5.21 1066 1066 A 21 GLU HBy A 22 ASP H 1.0 . 4.63 1067 1067 A 21 GLU HA A 24 GLY HAy 1.0 . 5.21 1068 1068 A 21 GLU HA A 24 GLY HAx 1.0 . 5.21 1069 1069 A 15 MET HE% A 22 ASP H 1.0 . 6.31 1070 1070 A 20 ILE H A 22 ASP H 1.0 . 4.56 1071 1071 A 21 GLU H A 22 ASP H 1.0 . 3.89 1072 1072 A 21 GLU H A 22 ASP H 1.0 . 4.66 1073 1073 A 22 ASP H A 22 ASP HBy 1.0 . 3.44 1074 1074 A 22 ASP H A 22 ASP HBx 1.0 . 3.29 1075 1075 A 22 ASP H A 22 ASP HA 1.0 . 3.40 1076 1076 A 22 ASP HBx A 22 ASP HA 1.0 . 3.17 1077 1077 A 22 ASP HBy A 22 ASP HA 1.0 . 3.00 1078 1078 A 22 ASP H A 22 ASP HA 1.0 . 3.27 1079 1079 A 22 ASP HBy A 22 ASP HA 1.0 . 3.04 1080 1080 A 22 ASP H A 22 ASP HBy 1.0 . 3.44 1081 1081 A 22 ASP H A 22 ASP HBx 1.0 . 3.49 1082 1082 A 22 ASP HBx A 22 ASP HA 1.0 . 2.78 1083 1083 A 15 MET HE% A 23 ARG H 1.0 . 5.68 1084 1084 A 20 ILE HG2% A 23 ARG H 1.0 . 4.98 1085 1085 A 21 GLU HA A 23 ARG H 1.0 . 5.74 1086 1086 A 22 ASP HBx A 23 ARG H 1.0 . 3.52 1087 1087 A 22 ASP H A 23 ARG HA 1.0 . 3.45 1088 1088 A 19 ASP HA A 22 ASP H 1.0 . 0.00 1089 1089 A 23 ARG H A 22 ASP HA 1.0 . 3.53 1090 1090 A 22 ASP H A 23 ARG H 1.0 . 3.85 1091 1091 A 22 ASP H A 23 ARG HBy 1.0 . 6.31 1092 1092 A 22 ASP H A 23 ARG H 1.0 . 3.79 1093 1093 A 22 ASP HBy A 23 ARG H 1.0 . 4.18 1094 1094 A 22 ASP HBx A 23 ARG H 1.0 . 3.84 1095 1095 A 23 ARG H A 22 ASP HA 1.0 . 3.70 1096 1096 A 23 ARG H A 23 ARG HA 1.0 . 3.44 1097 1097 A 23 ARG H A 23 ARG HGy 1.0 . 4.05 1098 1098 A 23 ARG H A 23 ARG HGx 1.0 . 4.05 1099 1099 A 23 ARG H A 23 ARG HBy 1.0 . 0.00 1100 1100 A 23 ARG H A 23 ARG HDy 1.0 . 4.54 1101 1101 A 23 ARG H A 23 ARG HBx 1.0 . 3.73 1102 1102 A 23 ARG H A 23 ARG HA 1.0 . 3.35 1103 1103 A 23 ARG HA A 23 ARG HDy 1.0 . 5.21 1104 1104 A 23 ARG HA A 23 ARG HBy 1.0 . 3.55 1105 1105 A 23 ARG HBy A 23 ARG HDx 1.0 . 4.37 1106 1106 A 23 ARG HBx A 23 ARG HDx 1.0 . 4.54 1107 1107 A 23 ARG HGy A 23 ARG HDy 1.0 . 3.53 1108 1108 A 23 ARG H A 23 ARG HGx 1.0 . 4.01 1109 1109 A 23 ARG HGx A 23 ARG HDy 1.0 . 3.47 1110 1110 A 23 ARG HBy A 23 ARG HDy 1.0 . 0.00 1111 1111 A 23 ARG H A 23 ARG HGy 1.0 . 4.09 1112 1112 A 23 ARG HGx A 23 ARG HDx 1.0 . 4.10 1113 1113 A 23 ARG H A 23 ARG HBx 1.0 . 3.81 1114 1114 A 23 ARG HGx A 23 ARG HDy 1.0 . 4.13 1115 1115 A 23 ARG HA A 23 ARG HGy 1.0 . 2.95 1116 1116 A 23 ARG HGx A 23 ARG HBx 1.0 . 3.87 1117 1117 A 23 ARG HGy A 23 ARG HDy 1.0 . 3.99 1118 1118 A 23 ARG HDy A 23 ARG HBx 1.0 . 3.54 1119 1119 A 23 ARG HA A 23 ARG HBx 1.0 . 3.39 1120 1120 A 23 ARG HDy A 23 ARG HBx 1.0 . 4.23 1121 1121 A 23 ARG H A 23 ARG HBy 1.0 . 4.66 1122 1122 A 23 ARG HA A 23 ARG HDy 1.0 . 5.21 1123 1123 A 23 ARG HBx A 23 ARG HDx 1.0 . 4.26 1124 1124 A 23 ARG HGy A 23 ARG HBx 1.0 . 3.63 1125 1125 A 23 ARG HA A 23 ARG HGy 1.0 . 3.50 1126 1126 A 23 ARG HGy A 23 ARG HDx 1.0 . 3.99 1127 1127 A 23 ARG HA A 23 ARG HBx 1.0 . 3.51 1128 1128 A 23 ARG HBy A 23 ARG HDx 1.0 . 3.43 1129 1129 A 23 ARG HGx A 23 ARG HDx 1.0 . 0.00 1130 1130 A 23 ARG HGy A 23 ARG HDx 1.0 . 3.66 1131 1131 A 23 ARG H A 23 ARG HDy 1.0 . 4.65 1132 1132 A 23 ARG HBy A 23 ARG HDy 1.0 . 5.18 1133 1133 A 23 ARG HA A 23 ARG HDx 1.0 . 5.21 1134 1134 A 23 ARG HA A 23 ARG HGx 1.0 . 3.46 1135 1135 A 23 ARG HA A 23 ARG HDx 1.0 . 5.21 1136 1136 A 23 ARG H A 23 ARG HDx 1.0 . 4.65 1137 1137 A 23 ARG HA A 24 GLY H 1.0 . 3.74 1138 1138 A 23 ARG H A 24 GLY HAx 1.0 . 5.29 1139 1139 A 23 ARG HBy A 24 GLY H 1.0 . 4.28 1140 1140 A 23 ARG HBx A 24 GLY H 1.0 . 4.84 1141 1141 A 23 ARG H A 24 GLY HAy 1.0 . 5.21 1142 1142 A 23 ARG H A 24 GLY HAx 1.0 . 5.21 1143 1143 A 23 ARG HA A 24 GLY H 1.0 . 3.99 1144 1144 A 24 GLY HAx A 23 ARG HA 1.0 . 5.21 1145 1145 A 23 ARG HBx A 24 GLY H 1.0 . 4.88 1146 1146 A 23 ARG HA A 25 PHE H 1.0 . 4.50 1147 1147 A 23 ARG HA A 25 PHE HE% 1.0 . 4.34 1148 1148 A 23 ARG HA A 25 PHE HD% 1.0 . 4.14 1149 1149 A 23 ARG HA A 25 PHE H 1.0 . 5.21 1150 1150 A 30 ILE HD1% A 23 ARG HBx 1.0 . 5.21 1151 1151 A 40 LEU HD21 A 23 ARG HBx 1.0 . 0.00 1152 1152 A 30 ILE HD1% A 23 ARG HDy 1.0 . 3.97 1153 1153 A 40 LEU HD21 A 23 ARG HDy 1.0 . 0.00 1154 1154 A 40 LEU HD21 A 23 ARG HDx 1.0 . 5.21 1155 1155 A 21 GLU HA A 24 GLY H 1.0 . 3.70 1156 1156 A 25 PHE HA A 24 GLY H 1.0 . 0.00 1157 1157 A 21 GLU HA A 24 GLY H 1.0 . 4.00 1158 1158 A 22 ASP HBx A 24 GLY H 1.0 . 5.29 1159 1159 A 25 PHE HBy A 24 GLY H 1.0 . 0.00 1160 1160 A 22 ASP HBy A 24 GLY H 1.0 . 5.29 1161 1161 A 22 ASP HA A 24 GLY H 1.0 . 3.60 1162 1162 A 22 ASP H A 24 GLY H 1.0 . 4.58 1163 1163 A 22 ASP HA A 24 GLY H 1.0 . 3.89 1164 1164 A 23 ARG H A 24 GLY H 1.0 . 3.35 1165 1165 A 23 ARG H A 24 GLY H 1.0 . 3.67 1166 1166 A 24 GLY HAx A 24 GLY H 1.0 . 3.29 1167 1167 A 24 GLY HAy A 24 GLY H 1.0 . 3.40 1168 1168 A 24 GLY HAy A 24 GLY H 1.0 . 3.36 1169 1169 A 24 GLY HAx A 24 GLY H 1.0 . 3.33 1170 1170 A 24 GLY H A 25 PHE H 1.0 . 3.61 1171 1171 A 24 GLY H A 25 PHE H 1.0 . 3.22 1172 1172 A 20 ILE HG2% A 25 PHE H 1.0 . 4.21 1173 1173 A 20 ILE HG2% A 25 PHE HA 1.0 . 4.34 1174 1174 A 20 ILE HG2% A 25 PHE H 1.0 . 4.37 1175 1175 A 21 GLU HA A 25 PHE H 1.0 . 4.05 1176 1176 A 21 GLU HA A 25 PHE H 1.0 . 4.41 1177 1177 A 22 ASP H A 25 PHE H 1.0 . 5.09 1178 1178 A 23 ARG HBx A 25 PHE HD% 1.0 . 4.05 1179 1179 A 23 ARG H A 25 PHE HD% 1.0 . 4.29 1180 1180 A 23 ARG HGx A 25 PHE HD% 1.0 . 4.65 1181 1181 A 23 ARG HDx A 25 PHE HD% 1.0 . 4.34 1182 1182 A 23 ARG HGy A 25 PHE HD% 1.0 . 4.65 1183 1183 A 23 ARG HDy A 25 PHE HD% 1.0 . 4.13 1184 1184 A 23 ARG HBx A 25 PHE HD% 1.0 . 3.67 1185 1185 A 23 ARG HBy A 25 PHE HD% 1.0 . 4.25 1186 1186 A 24 GLY HAy A 25 PHE H 1.0 . 4.28 1187 1187 A 24 GLY H A 25 PHE HD% 1.0 . 4.65 1188 1188 A 24 GLY HAx A 25 PHE H 1.0 . 4.15 1189 1189 A 24 GLY HAx A 25 PHE H 1.0 . 4.06 1190 1190 A 24 GLY HAy A 25 PHE HD% 1.0 . 5.85 1191 1191 A 24 GLY HAx A 25 PHE HD% 1.0 . 4.70 1192 1192 A 24 GLY HAy A 25 PHE H 1.0 . 4.09 1193 1193 A 25 PHE H A 25 PHE HD% 1.0 . 4.52 1194 1194 A 25 PHE H A 25 PHE HE% 1.0 . 5.01 1195 1195 A 25 PHE HA A 25 PHE HE% 1.0 . 5.67 1196 1196 A 25 PHE HE% A 25 PHE HD% 1.0 . 2.90 1197 1197 A 25 PHE HA A 25 PHE H 1.0 . 3.59 1198 1198 A 25 PHE H A 25 PHE HD% 1.0 . 3.70 1199 1199 A 25 PHE H A 25 PHE HE% 1.0 . 4.42 1200 1200 A 25 PHE HBy A 25 PHE H 1.0 . 4.05 1201 1201 A 25 PHE HA A 25 PHE HD% 1.0 . 3.63 1202 1202 A 25 PHE HBx A 25 PHE H 1.0 . 4.56 1203 1203 A 25 PHE HBx A 25 PHE HA 1.0 . 3.34 1204 1204 A 25 PHE HA A 25 PHE H 1.0 . 3.90 1205 1205 A 25 PHE HBx A 25 PHE HD% 1.0 . 3.66 1206 1206 A 25 PHE HBy A 25 PHE HD% 1.0 . 3.80 1207 1207 A 25 PHE HBy A 25 PHE H 1.0 . 3.89 1208 1208 A 30 ILE HD1% A 25 PHE H 1.0 . 5.55 1209 1209 A 30 ILE HG2% A 25 PHE HD% 1.0 . 4.61 1210 1210 A 13 PHE HE% A 30 ILE HG2% 1.0 . 0.00 1211 1211 A 30 ILE HD1% A 25 PHE HD% 1.0 . 3.97 1212 1212 A 13 PHE HE% A 30 ILE HD1% 1.0 . 0.00 1213 1213 A 25 PHE HE% A 36 ARG HDy 1.0 . 5.21 1214 1214 A 25 PHE HE% A 36 ARG HDx 1.0 . 5.21 1215 1215 A 25 PHE HD% A 39 GLU HGy 1.0 . 3.44 1216 1216 A 25 PHE HBy A 25 PHE HD% 1.0 . 0.00 1217 1217 A 25 PHE HD% A 39 GLU HBx 1.0 . 4.58 1218 1218 A 39 GLU HBx A 41 PHE HD% 1.0 . 0.00 1219 1219 A 25 PHE HD% A 39 GLU HGx 1.0 . 4.48 1220 1220 A 41 PHE HD% A 39 GLU HGx 1.0 . 0.00 1221 1221 A 25 PHE HD% A 39 GLU HGy 1.0 . 4.47 1222 1222 A 39 GLU HGy A 41 PHE HD% 1.0 . 0.00 1223 1223 A 25 PHE HD% A 40 LEU H 1.0 . 4.85 1224 1224 A 41 PHE HD% A 40 LEU H 1.0 . 0.00 1225 1225 A 25 PHE HD% A 40 LEU HA 1.0 . 4.65 1226 1226 A 41 PHE HD% A 40 LEU HA 1.0 . 0.00 1227 1227 A 25 PHE HA A 26 ASP H 1.0 . 4.06 1228 1228 A 25 PHE H A 26 ASP H 1.0 . 5.40 1229 1229 A 25 PHE HA A 26 ASP HBx 1.0 . 3.32 1230 1230 A 25 PHE HBy A 25 PHE HA 1.0 . 0.00 1231 1231 A 25 PHE HA A 26 ASP HBx 1.0 . 5.21 1232 1232 A 25 PHE HA A 26 ASP H 1.0 . 3.66 1233 1233 A 25 PHE HA A 26 ASP HBy 1.0 . 5.21 1234 1234 A 26 ASP H A 26 ASP HBy 1.0 . 3.70 1235 1235 A 25 PHE HBy A 26 ASP H 1.0 . 0.00 1236 1236 A 26 ASP H A 26 ASP HA 1.0 . 4.68 1237 1237 A 26 ASP H A 26 ASP HBx 1.0 . 3.69 1238 1238 A 26 ASP H A 26 ASP HBy 1.0 . 3.89 1239 1239 A 26 ASP H A 26 ASP HBx 1.0 . 3.93 1240 1240 A 26 ASP HBx A 26 ASP HA 1.0 . 3.31 1241 1241 A 26 ASP HBy A 26 ASP HA 1.0 . 3.66 1242 1242 A 26 ASP HBx A 26 ASP HA 1.0 . 3.59 1243 1243 A 26 ASP HBy A 27 ARG H 1.0 . 5.03 1244 1244 A 26 ASP HBx A 27 ARG H 1.0 . 4.65 1245 1245 A 26 ASP HBy A 27 ARG H 1.0 . 4.65 1246 1246 A 26 ASP HBx A 28 GLU H 1.0 . 4.95 1247 1247 A 26 ASP HBy A 28 GLU H 1.0 . 4.95 1248 1248 A 26 ASP HBy A 28 GLU H 1.0 . 5.21 1249 1249 A 26 ASP HBx A 28 GLU H 1.0 . 5.24 1250 1250 A 26 ASP HBy A 29 GLU H 1.0 . 3.79 1251 1251 A 41 PHE HBx A 41 PHE H 1.0 . 0.00 1252 1252 A 26 ASP H A 29 GLU HBx 1.0 . 4.68 1253 1253 A 26 ASP H A 29 GLU HGy 1.0 . 4.68 1254 1254 A 26 ASP HBy A 29 GLU H 1.0 . 5.22 1255 1255 A 26 ASP HBx A 29 GLU HBy 1.0 . 3.86 1256 1256 A 26 ASP HBx A 29 GLU HGx 1.0 . 3.99 1257 1257 A 26 ASP HBx A 29 GLU H 1.0 . 5.51 1258 1258 A 26 ASP HBy A 29 GLU HBx 1.0 . 3.67 1259 1259 A 26 ASP HBx A 29 GLU HBx 1.0 . 3.54 1260 1260 A 26 ASP HBx A 29 GLU HBy 1.0 . 4.03 1261 1261 A 26 ASP HBx A 29 GLU HBx 1.0 . 3.65 1262 1262 A 26 ASP HBy A 29 GLU HBy 1.0 . 4.42 1263 1263 A 26 ASP HBx A 29 GLU HGy 1.0 . 3.99 1264 1264 A 20 ILE HG2% A 27 ARG HA 1.0 . 4.18 1265 1265 A 20 ILE HD1% A 27 ARG HA 1.0 . 4.99 1266 1266 A 26 ASP HA A 27 ARG H 1.0 . 3.97 1267 1267 A 27 ARG HBx A 27 ARG H 1.0 . 4.62 1268 1268 A 27 ARG H A 27 ARG HA 1.0 . 5.42 1269 1269 A 27 ARG H A 27 ARG HGy 1.0 . 4.98 1270 1270 A 27 ARG HDy A 27 ARG H 1.0 . 5.24 1271 1271 A 27 ARG HDy A 27 ARG HBx 1.0 . 3.94 1272 1272 A 27 ARG H A 27 ARG HA 1.0 . 4.69 1273 1273 A 27 ARG HBx A 27 ARG HA 1.0 . 3.50 1274 1274 A 27 ARG HDy A 27 ARG HA 1.0 . 5.55 1275 1275 A 27 ARG HBx A 27 ARG H 1.0 . 5.21 1276 1276 A 27 ARG HA A 27 ARG HGx 1.0 . 3.80 1277 1277 A 27 ARG HDy A 27 ARG HGx 1.0 . 3.91 1278 1278 A 27 ARG HGx A 27 ARG HDx 1.0 . 3.69 1279 1279 A 27 ARG HDx A 27 ARG HBy 1.0 . 3.19 1280 1280 A 27 ARG HA A 27 ARG HDx 1.0 . 5.53 1281 1281 A 27 ARG HDy A 27 ARG HGy 1.0 . 3.98 1282 1282 A 27 ARG HGy A 27 ARG HDx 1.0 . 3.86 1283 1283 A 27 ARG H A 27 ARG HBy 1.0 . 5.80 1284 1284 A 27 ARG HA A 27 ARG HGx 1.0 . 4.37 1285 1285 A 27 ARG HGx A 27 ARG HDx 1.0 . 5.85 1286 1286 A 27 ARG HBx A 27 ARG HDx 1.0 . 3.21 1287 1287 A 27 ARG HA A 27 ARG HBy 1.0 . 4.51 1288 1288 A 27 ARG HDy A 27 ARG HGx 1.0 . 5.85 1289 1289 A 27 ARG HBx A 27 ARG HA 1.0 . 4.72 1290 1290 A 27 ARG HA A 27 ARG HGy 1.0 . 6.15 1291 1291 A 27 ARG HGy A 27 ARG HDx 1.0 . 3.96 1292 1292 A 27 ARG H A 27 ARG HGy 1.0 . 6.30 1293 1293 A 27 ARG H A 27 ARG HGx 1.0 . 4.56 1294 1294 A 27 ARG H A 28 GLU H 1.0 . 4.60 1295 1295 A 27 ARG H A 28 GLU H 1.0 . 5.47 1296 1296 A 27 ARG HA A 30 ILE H 1.0 . 4.05 1297 1297 A 27 ARG HA A 30 ILE HB 1.0 . 4.29 1298 1298 A 27 ARG HA A 30 ILE H 1.0 . 5.18 1299 1299 A 27 ARG HA A 30 ILE HA 1.0 . 5.85 1300 1300 A 30 ILE HD1% A 27 ARG HA 1.0 . 5.11 1301 1301 A 30 ILE HG2% A 27 ARG HA 1.0 . 5.21 1302 1302 A 30 ILE HD1% A 27 ARG HA 1.0 . 5.21 1303 1303 A 30 ILE HG2% A 27 ARG HA 1.0 . 5.21 1304 1304 A 71 LEU HDx% A 27 ARG HA 1.0 . 3.70 1305 1305 A 20 ILE HD1% A 27 ARG HA 1.0 . 0.00 1306 1306 A 71 LEU HDx% A 27 ARG HA 1.0 . 4.90 1307 1307 A 71 LEU HDx% A 70 GLY HAy 1.0 . 0.00 1308 1308 A 71 LEU HDx% A 27 ARG HA 1.0 . 3.96 1309 1309 A 20 ILE HG2% A 27 ARG HA 1.0 . 0.00 1310 1310 A 26 ASP HA A 28 GLU H 1.0 . 4.92 1311 1311 A 27 ARG HBx A 28 GLU H 1.0 . 4.09 1312 1312 A 28 GLU H A 27 ARG HGx 1.0 . 4.02 1313 1313 A 28 GLU H A 27 ARG HGy 1.0 . 4.41 1314 1314 A 28 GLU H A 27 ARG HGy 1.0 . 6.07 1315 1315 A 28 GLU H A 27 ARG HGx 1.0 . 5.22 1316 1316 A 28 GLU H A 27 ARG HA 1.0 . 5.39 1317 1317 A 28 GLU H A 28 GLU HBy 1.0 . 3.61 1318 1318 A 28 GLU H A 28 GLU HBx 1.0 . 3.61 1319 1319 A 28 GLU H A 28 GLU HA 1.0 . 4.04 1320 1320 A 28 GLU H A 28 GLU HGx 1.0 . 3.36 1321 1321 A 28 GLU H A 28 GLU HBx 1.0 . 3.99 1322 1322 A 28 GLU HBx A 28 GLU HA 1.0 . 3.09 1323 1323 A 28 GLU HBy A 28 GLU HA 1.0 . 3.10 1324 1324 A 28 GLU HBx A 28 GLU HA 1.0 . 3.16 1325 1325 A 28 GLU H A 28 GLU HGx 1.0 . 3.48 1326 1326 A 28 GLU H A 28 GLU HA 1.0 . 4.31 1327 1327 A 28 GLU H A 28 GLU HGy 1.0 . 3.63 1328 1328 A 28 GLU HA A 28 GLU HGx 1.0 . 3.99 1329 1329 A 28 GLU H A 28 GLU HBy 1.0 . 3.99 1330 1330 A 28 GLU HA A 28 GLU HGx 1.0 . 3.99 1331 1331 A 28 GLU HGx A 29 GLU HA 1.0 . 0.00 1332 1332 A 28 GLU HBy A 28 GLU HA 1.0 . 2.95 1333 1333 A 28 GLU H A 29 GLU H 1.0 . 3.62 1334 1334 A 29 GLU H A 28 GLU HBx 1.0 . 4.54 1335 1335 A 28 GLU H A 29 GLU H 1.0 . 3.85 1336 1336 A 28 GLU H A 29 GLU HGx 1.0 . 5.21 1337 1337 A 29 GLU H A 28 GLU HBx 1.0 . 5.21 1338 1338 A 28 GLU H A 29 GLU HA 1.0 . 5.21 1339 1339 A 28 GLU HGy A 29 GLU HA 1.0 . 3.99 1340 1340 A 28 GLU HA A 28 GLU HGy 1.0 . 0.00 1341 1341 A 28 GLU H A 29 GLU HGy 1.0 . 5.21 1342 1342 A 28 GLU H A 30 ILE H 1.0 . 5.18 1343 1343 A 28 GLU HA A 31 TRP HD1 1.0 . 3.06 1344 1344 A 28 GLU HA A 31 TRP H 1.0 . 4.21 1345 1345 A 28 GLU HBx A 31 TRP H 1.0 . 5.85 1346 1346 A 28 GLU HA A 31 TRP HBy 1.0 . 5.21 1347 1347 A 28 GLU HA A 32 TYR HE% 1.0 . 4.43 1348 1348 A 28 GLU HA A 32 TYR HD% 1.0 . 4.30 1349 1349 A 29 GLU HA A 32 TYR HD% 1.0 . 0.00 1350 1350 A 28 GLU HBx A 32 TYR HE% 1.0 . 3.70 1351 1351 A 28 GLU HBy A 32 TYR HE% 1.0 . 3.93 1352 1352 A 28 GLU HBx A 32 TYR HD% 1.0 . 4.33 1353 1353 A 28 GLU HBy A 32 TYR HD% 1.0 . 4.33 1354 1354 A 28 GLU HGy A 32 TYR HE% 1.0 . 4.33 1355 1355 A 28 GLU HGy A 32 TYR HD% 1.0 . 5.05 1356 1356 A 28 GLU HGx A 32 TYR HE% 1.0 . 5.05 1357 1357 A 28 GLU HGy A 32 TYR HD% 1.0 . 5.21 1358 1358 A 28 GLU HGx A 32 TYR HD% 1.0 . 5.21 1359 1359 A 28 GLU HBx A 32 TYR HD% 1.0 . 4.35 1360 1360 A 28 GLU HGy A 32 TYR HE% 1.0 . 4.35 1361 1361 A 28 GLU HGx A 32 TYR HE% 1.0 . 5.83 1362 1362 A 28 GLU HA A 32 TYR HD% 1.0 . 4.43 1363 1363 A 29 GLU H A 29 GLU HGx 1.0 . 3.82 1364 1364 A 29 GLU H A 29 GLU HBy 1.0 . 4.02 1365 1365 A 29 GLU H A 29 GLU HA 1.0 . 4.24 1366 1366 A 29 GLU H A 29 GLU HBx 1.0 . 3.72 1367 1367 A 29 GLU H A 29 GLU HGy 1.0 . 3.99 1368 1368 A 29 GLU HBx A 29 GLU HA 1.0 . 3.25 1369 1369 A 29 GLU H A 29 GLU HGx 1.0 . 3.99 1370 1370 A 29 GLU H A 29 GLU HA 1.0 . 4.06 1371 1371 A 29 GLU HBx A 29 GLU HA 1.0 . 3.69 1372 1372 A 29 GLU HBy A 29 GLU HA 1.0 . 2.99 1373 1373 A 29 GLU H A 29 GLU HBx 1.0 . 3.65 1374 1374 A 29 GLU HBy A 29 GLU HA 1.0 . 3.22 1375 1375 A 29 GLU HGx A 29 GLU HA 1.0 . 3.99 1376 1376 A 29 GLU HGy A 29 GLU HA 1.0 . 3.99 1377 1377 A 29 GLU H A 29 GLU HBy 1.0 . 4.15 1378 1378 A 29 GLU HGx A 29 GLU HA 1.0 . 3.99 1379 1379 A 29 GLU HBy A 30 ILE H 1.0 . 4.05 1380 1380 A 29 GLU H A 30 ILE H 1.0 . 4.39 1381 1381 A 29 GLU H A 31 TRP H 1.0 . 0.00 1382 1382 A 29 GLU H A 30 ILE H 1.0 . 2.96 1383 1383 A 30 ILE H A 29 GLU HA 1.0 . 3.33 1384 1384 A 29 GLU H A 30 ILE HA 1.0 . 5.91 1385 1385 A 30 ILE HG2% A 29 GLU HBy 1.0 . 6.37 1386 1386 A 30 ILE H A 29 GLU HA 1.0 . 4.00 1387 1387 A 29 GLU H A 31 TRP H 1.0 . 4.62 1388 1388 A 29 GLU HBy A 31 TRP H 1.0 . 4.27 1389 1389 A 29 GLU HBy A 30 ILE H 1.0 . 0.00 1390 1390 A 29 GLU HA A 32 TYR H 1.0 . 4.62 1391 1391 A 29 GLU HA A 32 TYR HBx 1.0 . 4.27 1392 1392 A 29 GLU HA A 32 TYR HBx 1.0 . 4.61 1393 1393 A 29 GLU HA A 32 TYR H 1.0 . 4.39 1394 1394 A 29 GLU HA A 32 TYR HD% 1.0 . 4.22 1395 1395 A 29 GLU HA A 32 TYR HBy 1.0 . 4.34 1396 1396 A 15 MET HE% A 30 ILE HD1% 1.0 . 3.79 1397 1397 A 30 ILE HD1% A 20 ILE HG1x 1.0 . 5.21 1398 1398 A 25 PHE HBy A 30 ILE HG2% 1.0 . 5.53 1399 1399 A 30 ILE HD1% A 25 PHE HBy 1.0 . 4.01 1400 1400 A 30 ILE HD1% A 25 PHE HBy 1.0 . 5.07 1401 1401 A 30 ILE HD1% A 25 PHE HBx 1.0 . 4.95 1402 1402 A 30 ILE HD1% A 25 PHE HBx 1.0 . 4.10 1403 1403 A 29 GLU HGx A 30 ILE H 1.0 . 5.29 1404 1404 A 29 GLU HGx A 30 ILE H 1.0 . 4.65 1405 1405 A 29 GLU HGy A 30 ILE H 1.0 . 4.65 1406 1406 A 30 ILE H A 30 ILE HG1y 1.0 . 2.99 1407 1407 A 30 ILE H A 30 ILE HG1x 1.0 . 5.31 1408 1408 A 30 ILE H A 30 ILE HA 1.0 . 3.10 1409 1409 A 30 ILE HD1% A 30 ILE H 1.0 . 4.20 1410 1410 A 30 ILE H A 30 ILE HG1x 1.0 . 3.21 1411 1411 A 30 ILE H A 30 ILE HB 1.0 . 3.12 1412 1412 A 30 ILE HG2% A 30 ILE H 1.0 . 4.05 1413 1413 A 30 ILE HD1% A 30 ILE HG1x 1.0 . 3.79 1414 1414 A 30 ILE HD1% A 30 ILE HA 1.0 . 3.75 1415 1415 A 30 ILE HD1% A 30 ILE HG1x 1.0 . 3.71 1416 1416 A 30 ILE HB A 30 ILE HA 1.0 . 3.88 1417 1417 A 30 ILE HD1% A 30 ILE HG2% 1.0 . 2.92 1418 1418 A 40 LEU HD21 A 30 ILE HG2% 1.0 . 0.00 1419 1419 A 73 ILE HD1% A 30 ILE HG2% 1.0 . 0.00 1420 1420 A 30 ILE HB A 30 ILE HG1x 1.0 . 4.45 1421 1421 A 30 ILE HG2% A 30 ILE HB 1.0 . 3.20 1422 1422 A 30 ILE HG2% A 30 ILE HA 1.0 . 3.56 1423 1423 A 30 ILE HG2% A 30 ILE HG1x 1.0 . 3.57 1424 1424 A 30 ILE HA A 30 ILE HG1x 1.0 . 5.06 1425 1425 A 30 ILE H A 30 ILE HG1x 1.0 . 4.61 1426 1426 A 30 ILE H A 30 ILE HA 1.0 . 4.02 1427 1427 A 30 ILE HG2% A 30 ILE H 1.0 . 5.21 1428 1428 A 30 ILE HD1% A 30 ILE HA 1.0 . 3.70 1429 1429 A 30 ILE HD1% A 30 ILE HB 1.0 . 3.79 1430 1430 A 30 ILE H A 30 ILE HG1y 1.0 . 5.32 1431 1431 A 30 ILE HG2% A 30 ILE HA 1.0 . 3.57 1432 1432 A 30 ILE HB A 30 ILE HA 1.0 . 4.58 1433 1433 A 30 ILE HG2% A 30 ILE HB 1.0 . 3.37 1434 1434 A 30 ILE H A 30 ILE HB 1.0 . 4.17 1435 1435 A 30 ILE HD1% A 30 ILE HG1y 1.0 . 3.81 1436 1436 A 30 ILE HD1% A 30 ILE H 1.0 . 4.01 1437 1437 A 30 ILE HD1% A 30 ILE HG1y 1.0 . 4.08 1438 1438 A 30 ILE HD1% A 30 ILE HG2% 1.0 . 2.77 1439 1439 A 30 ILE HG2% A 31 TRP HE3 1.0 . 4.31 1440 1440 A 30 ILE HG2% A 31 TRP HE3 1.0 . 4.14 1441 1441 A 30 ILE HD1% A 37 SER HA 1.0 . 3.76 1442 1442 A 30 ILE HG2% A 37 SER HBx 1.0 . 4.01 1443 1443 A 30 ILE HD1% A 37 SER HA 1.0 . 3.60 1444 1444 A 30 ILE HG2% A 37 SER HBy 1.0 . 3.83 1445 1445 A 30 ILE HG2% A 37 SER HA 1.0 . 3.57 1446 1446 A 30 ILE HB A 41 PHE HE% 1.0 . 6.36 1447 1447 A 41 PHE HE% A 36 ARG HBy 1.0 . 0.00 1448 1448 A 73 ILE HD1% A 30 ILE HB 1.0 . 4.16 1449 1449 A 30 ILE HD1% A 30 ILE HB 1.0 . 0.00 1450 1450 A 29 GLU HA A 31 TRP H 1.0 . 4.26 1451 1451 A 28 GLU HA A 31 TRP H 1.0 . 0.00 1452 1452 A 29 GLU HA A 31 TRP H 1.0 . 4.17 1453 1453 A 30 ILE HG2% A 31 TRP H 1.0 . 4.57 1454 1454 A 30 ILE HD1% A 31 TRP H 1.0 . 5.29 1455 1455 A 30 ILE HA A 31 TRP H 1.0 . 4.66 1456 1456 A 30 ILE HG2% A 31 TRP HA 1.0 . 4.51 1457 1457 A 30 ILE HB A 31 TRP H 1.0 . 4.18 1458 1458 A 31 TRP H A 30 ILE HG1x 1.0 . 4.62 1459 1459 A 30 ILE HD1% A 31 TRP H 1.0 . 5.21 1460 1460 A 30 ILE HA A 31 TRP H 1.0 . 4.11 1461 1461 A 30 ILE HG2% A 31 TRP H 1.0 . 3.74 1462 1462 A 31 TRP HE1 A 31 TRP HD1 1.0 . 2.95 1463 1463 A 31 TRP HZ3 A 31 TRP HH2 1.0 . 2.95 1464 1464 A 31 TRP HD1 A 31 TRP HBx 1.0 . 4.76 1465 1465 A 31 TRP HE3 A 31 TRP HZ3 1.0 . 3.08 1466 1466 A 31 TRP HE3 A 31 TRP HA 1.0 . 2.73 1467 1467 A 31 TRP HE3 A 31 TRP HZ3 1.0 . 3.51 1468 1468 A 31 TRP HE3 A 31 TRP HBx 1.0 . 5.05 1469 1469 A 31 TRP HD1 A 31 TRP HBy 1.0 . 4.52 1470 1470 A 31 TRP HZ3 A 31 TRP HZ2 1.0 . 4.33 1471 1471 A 31 TRP HH2 A 31 TRP HZ2 1.0 . 2.65 1472 1472 A 31 TRP HBy A 31 TRP HE3 1.0 . 5.05 1473 1473 A 31 TRP HH2 A 31 TRP HZ2 1.0 . 2.94 1474 1474 A 31 TRP HZ3 A 31 TRP HH2 1.0 . 2.97 1475 1475 A 31 TRP HD1 A 31 TRP H 1.0 . 3.86 1476 1476 A 31 TRP HE1 A 31 TRP HZ2 1.0 . 3.86 1477 1477 A 31 TRP HD1 A 31 TRP H 1.0 . 4.05 1478 1478 A 31 TRP HE1 A 31 TRP H 1.0 . 5.94 1479 1479 A 31 TRP H A 31 TRP HA 1.0 . 3.21 1480 1480 A 31 TRP HE1 A 31 TRP HD1 1.0 . 3.82 1481 1481 A 31 TRP H A 31 TRP HBy 1.0 . 3.63 1482 1482 A 31 TRP H A 31 TRP HBx 1.0 . 3.55 1483 1483 A 31 TRP HE1 A 31 TRP HZ2 1.0 . 3.87 1484 1484 A 31 TRP HD1 A 31 TRP HBx 1.0 . 4.68 1485 1485 A 31 TRP HA A 31 TRP HBx 1.0 . 2.96 1486 1486 A 31 TRP H A 31 TRP HBy 1.0 . 3.78 1487 1487 A 31 TRP HE3 A 31 TRP HA 1.0 . 2.72 1488 1488 A 31 TRP H A 31 TRP HA 1.0 . 3.51 1489 1489 A 31 TRP HE3 A 31 TRP HBx 1.0 . 4.65 1490 1490 A 31 TRP HD1 A 31 TRP HBy 1.0 . 4.94 1491 1491 A 31 TRP HBy A 31 TRP HA 1.0 . 2.96 1492 1492 A 31 TRP HBy A 31 TRP HA 1.0 . 3.17 1493 1493 A 31 TRP HBy A 31 TRP HE3 1.0 . 4.65 1494 1494 A 31 TRP H A 31 TRP HBx 1.0 . 3.90 1495 1495 A 31 TRP HBy A 32 TYR HE% 1.0 . 4.26 1496 1496 A 32 TYR HE% A 32 TYR HBx 1.0 . 0.00 1497 1497 A 31 TRP H A 32 TYR HE% 1.0 . 5.05 1498 1498 A 31 TRP H A 32 TYR H 1.0 . 3.68 1499 1499 A 31 TRP H A 32 TYR H 1.0 . 3.67 1500 1500 A 31 TRP HBy A 32 TYR HD% 1.0 . 4.34 1501 1501 A 32 TYR HD% A 31 TRP HBx 1.0 . 4.34 1502 1502 A 71 LEU HDx% A 31 TRP HE1 1.0 . 4.55 1503 1503 A 30 ILE H A 32 TYR HD% 1.0 . 5.94 1504 1504 A 31 TRP HD1 A 32 TYR HD% 1.0 . 5.62 1505 1505 A 31 TRP HD1 A 32 TYR HE% 1.0 . 3.78 1506 1506 A 32 TYR H A 31 TRP HBx 1.0 . 4.50 1507 1507 A 31 TRP HBy A 32 TYR H 1.0 . 3.78 1508 1508 A 32 TYR H A 32 TYR HBx 1.0 . 0.00 1509 1509 A 31 TRP HBy A 32 TYR H 1.0 . 4.27 1510 1510 A 32 TYR H A 31 TRP HBx 1.0 . 4.34 1511 1511 A 32 TYR HD% A 32 TYR HBy 1.0 . 3.20 1512 1512 A 32 TYR HD% A 32 TYR HBx 1.0 . 3.14 1513 1513 A 32 TYR HE% A 32 TYR HD% 1.0 . 2.58 1514 1514 A 32 TYR HE% A 32 TYR HBy 1.0 . 4.41 1515 1515 A 32 TYR HE% A 32 TYR HD% 1.0 . 2.49 1516 1516 A 32 TYR HD% A 32 TYR H 1.0 . 3.45 1517 1517 A 32 TYR HE% A 32 TYR H 1.0 . 5.34 1518 1518 A 32 TYR H A 32 TYR HBy 1.0 . 4.22 1519 1519 A 32 TYR HD% A 32 TYR HBy 1.0 . 2.72 1520 1520 A 32 TYR H A 32 TYR HBx 1.0 . 3.94 1521 1521 A 32 TYR H A 32 TYR HBy 1.0 . 4.45 1522 1522 A 32 TYR HD% A 32 TYR HBx 1.0 . 2.72 1523 1523 A 25 PHE HD% A 33 ASN HD2x 1.0 . 6.36 1524 1524 A 29 GLU HGx A 33 ASN HD2x 1.0 . 5.29 1525 1525 A 29 GLU HBx A 33 ASN HD2x 1.0 . 4.58 1526 1526 A 29 GLU HA A 33 ASN HBx 1.0 . 5.21 1527 1527 A 26 ASP HBx A 29 GLU HA 1.0 . 0.00 1528 1528 A 29 GLU HA A 33 ASN HBx 1.0 . 5.85 1529 1529 A 30 ILE H A 33 ASN H 1.0 . 4.86 1530 1530 A 31 TRP H A 33 ASN H 1.0 . 0.00 1531 1531 A 30 ILE H A 33 ASN H 1.0 . 4.05 1532 1532 A 28 GLU H A 30 ILE H 1.0 . 0.00 1533 1533 A 30 ILE HA A 33 ASN H 1.0 . 5.22 1534 1534 A 32 TYR HD% A 33 ASN H 1.0 . 5.05 1535 1535 A 32 TYR H A 33 ASN HD2x 1.0 . 5.29 1536 1536 A 32 TYR H A 33 ASN H 1.0 . 3.37 1537 1537 A 32 TYR H A 33 ASN HD2y 1.0 . 4.29 1538 1538 A 32 TYR HD% A 32 TYR H 1.0 . 0.00 1539 1539 A 32 TYR HBx A 33 ASN H 1.0 . 4.54 1540 1540 A 32 TYR H A 33 ASN H 1.0 . 4.27 1541 1541 A 32 TYR HD% A 33 ASN H 1.0 . 4.05 1542 1542 A 33 ASN H A 33 ASN HD2y 1.0 . 0.00 1543 1543 A 33 ASN HD2x A 33 ASN H 1.0 . 4.05 1544 1544 A 33 ASN HBx A 33 ASN HD2y 1.0 . 4.05 1545 1545 A 33 ASN HD2x A 33 ASN H 1.0 . 4.05 1546 1546 A 33 ASN HD2x A 33 ASN HBx 1.0 . 4.05 1547 1547 A 33 ASN HD2y A 33 ASN HBy 1.0 . 4.05 1548 1548 A 33 ASN HD2x A 33 ASN HBy 1.0 . 4.05 1549 1549 A 33 ASN HBy A 33 ASN HA 1.0 . 4.25 1550 1550 A 33 ASN HBx A 33 ASN H 1.0 . 3.55 1551 1551 A 33 ASN HBx A 33 ASN HD2y 1.0 . 3.99 1552 1552 A 33 ASN H A 33 ASN HBy 1.0 . 3.55 1553 1553 A 33 ASN HBx A 33 ASN HA 1.0 . 3.95 1554 1554 A 33 ASN HBy A 33 ASN HA 1.0 . 3.99 1555 1555 A 33 ASN H A 33 ASN HA 1.0 . 4.52 1556 1556 A 33 ASN HBx A 33 ASN HA 1.0 . 4.17 1557 1557 A 33 ASN HD2x A 33 ASN HBy 1.0 . 3.99 1558 1558 A 33 ASN HD2x A 33 ASN HBx 1.0 . 3.99 1559 1559 A 33 ASN HD2y A 36 ARG HGx 1.0 . 5.94 1560 1560 A 33 ASN HD2x A 36 ARG HGy 1.0 . 5.94 1561 1561 A 33 ASN HD2x A 36 ARG HGx 1.0 . 5.94 1562 1562 A 33 ASN HD2y A 36 ARG HGy 1.0 . 5.94 1563 1563 A 36 ARG HBy A 33 ASN HBy 1.0 . 3.99 1564 1564 A 33 ASN HBy A 36 ARG HGx 1.0 . 4.47 1565 1565 A 33 ASN HBx A 36 ARG HGx 1.0 . 4.23 1566 1566 A 36 ARG HBy A 33 ASN HBx 1.0 . 3.99 1567 1567 A 34 ARG HGy A 34 ARG HDy 1.0 . 3.84 1568 1568 A 34 ARG HGy A 34 ARG HDx 1.0 . 3.94 1569 1569 A 34 ARG HDy A 34 ARG HA 1.0 . 4.47 1570 1570 A 34 ARG HDy A 34 ARG HBx 1.0 . 4.04 1571 1571 A 34 ARG HDx A 34 ARG HA 1.0 . 4.64 1572 1572 A 34 ARG HA A 34 ARG HBy 1.0 . 3.35 1573 1573 A 34 ARG HDy A 34 ARG HGx 1.0 . 3.69 1574 1574 A 34 ARG HDx A 34 ARG HBy 1.0 . 4.12 1575 1575 A 34 ARG HDx A 34 ARG HBx 1.0 . 3.98 1576 1576 A 34 ARG HDx A 34 ARG HA 1.0 . 4.67 1577 1577 A 34 ARG HA A 34 ARG HGx 1.0 . 4.42 1578 1578 A 34 ARG HDy A 34 ARG HA 1.0 . 4.72 1579 1579 A 34 ARG HDx A 34 ARG HBy 1.0 . 3.53 1580 1580 A 34 ARG HGy A 34 ARG HA 1.0 . 4.43 1581 1581 A 34 ARG HGy A 34 ARG HDx 1.0 . 3.35 1582 1582 A 34 ARG HDx A 34 ARG HGx 1.0 . 3.71 1583 1583 A 34 ARG HDy A 34 ARG HBy 1.0 . 4.42 1584 1584 A 34 ARG HBy A 35 GLU H 1.0 . 3.78 1585 1585 A 34 ARG HGx A 35 GLU HA 1.0 . 4.65 1586 1586 A 37 SER HBx A 34 ARG HA 1.0 . 4.68 1587 1587 A 34 ARG HGy A 35 GLU H 1.0 . 4.10 1588 1588 A 34 ARG HA A 35 GLU H 1.0 . 4.21 1589 1589 A 33 ASN H A 34 ARG HA 1.0 . 0.00 1590 1590 A 35 GLU H A 35 GLU HBy 1.0 . 3.61 1591 1591 A 35 GLU H A 35 GLU HGy 1.0 . 3.50 1592 1592 A 35 GLU H A 35 GLU HA 1.0 . 4.00 1593 1593 A 34 ARG HA A 35 GLU H 1.0 . 0.00 1594 1594 A 35 GLU H A 35 GLU HA 1.0 . 3.79 1595 1595 A 35 GLU H A 35 GLU HBx 1.0 . 3.99 1596 1596 A 35 GLU HA A 35 GLU HBy 1.0 . 3.17 1597 1597 A 35 GLU HA A 35 GLU HBx 1.0 . 3.17 1598 1598 A 35 GLU HA A 35 GLU HBx 1.0 . 3.18 1599 1599 A 35 GLU HA A 35 GLU HBy 1.0 . 2.76 1600 1600 A 35 GLU H A 35 GLU HBy 1.0 . 3.99 1601 1601 A 35 GLU HGy A 36 ARG H 1.0 . 4.05 1602 1602 A 35 GLU HBy A 36 ARG H 1.0 . 4.95 1603 1603 A 36 ARG HDx A 35 GLU HGy 1.0 . 4.36 1604 1604 A 35 GLU HGy A 36 ARG HA 1.0 . 3.99 1605 1605 A 35 GLU HBy A 36 ARG H 1.0 . 4.34 1606 1606 A 36 ARG HGx A 35 GLU HGy 1.0 . 4.83 1607 1607 A 36 ARG HGy A 35 GLU HGy 1.0 . 4.95 1608 1608 A 36 ARG HDy A 35 GLU HGy 1.0 . 4.78 1609 1609 A 35 GLU HBx A 36 ARG H 1.0 . 4.34 1610 1610 A 35 GLU HGy A 37 SER H 1.0 . 5.14 1611 1611 A 25 PHE HD% A 36 ARG HBy 1.0 . 4.65 1612 1612 A 41 PHE HD% A 36 ARG HBy 1.0 . 0.00 1613 1613 A 35 GLU H A 36 ARG H 1.0 . 4.01 1614 1614 A 35 GLU HA A 36 ARG H 1.0 . 3.61 1615 1615 A 35 GLU H A 36 ARG H 1.0 . 3.85 1616 1616 A 35 GLU HA A 36 ARG H 1.0 . 3.55 1617 1617 A 36 ARG H A 36 ARG HA 1.0 . 3.78 1618 1618 A 36 ARG HDy A 36 ARG H 1.0 . 4.76 1619 1619 A 36 ARG HGy A 36 ARG H 1.0 . 4.05 1620 1620 A 36 ARG HGx A 36 ARG H 1.0 . 4.05 1621 1621 A 36 ARG HBy A 36 ARG H 1.0 . 3.52 1622 1622 A 36 ARG HDx A 36 ARG HA 1.0 . 3.95 1623 1623 A 36 ARG HDy A 36 ARG HBy 1.0 . 4.20 1624 1624 A 36 ARG HGx A 36 ARG H 1.0 . 4.40 1625 1625 A 36 ARG HDx A 36 ARG H 1.0 . 4.77 1626 1626 A 36 ARG H A 36 ARG HBx 1.0 . 5.21 1627 1627 A 36 ARG HBy A 36 ARG H 1.0 . 4.45 1628 1628 A 36 ARG HDy A 36 ARG HBy 1.0 . 3.90 1629 1629 A 36 ARG HDy A 36 ARG HGy 1.0 . 4.06 1630 1630 A 36 ARG HGy A 36 ARG HA 1.0 . 4.23 1631 1631 A 36 ARG HGy A 36 ARG H 1.0 . 4.52 1632 1632 A 36 ARG H A 36 ARG HA 1.0 . 3.56 1633 1633 A 36 ARG HDy A 36 ARG HA 1.0 . 4.05 1634 1634 A 36 ARG HDy A 36 ARG HGx 1.0 . 3.82 1635 1635 A 36 ARG HGx A 36 ARG HA 1.0 . 4.46 1636 1636 A 36 ARG HDy A 36 ARG HA 1.0 . 3.45 1637 1637 A 36 ARG HDy A 36 ARG HGx 1.0 . 3.62 1638 1638 A 36 ARG HGy A 36 ARG HA 1.0 . 3.55 1639 1639 A 36 ARG HGx A 36 ARG HA 1.0 . 3.55 1640 1640 A 36 ARG HA A 36 ARG HBx 1.0 . 3.86 1641 1641 A 36 ARG HBy A 36 ARG HA 1.0 . 3.24 1642 1642 A 36 ARG HDx A 36 ARG HGx 1.0 . 3.56 1643 1643 A 36 ARG HDy A 36 ARG HBx 1.0 . 4.27 1644 1644 A 36 ARG HDx A 36 ARG HBy 1.0 . 3.86 1645 1645 A 36 ARG H A 37 SER H 1.0 . 3.75 1646 1646 A 36 ARG H A 37 SER H 1.0 . 3.73 1647 1647 A 37 SER HA A 36 ARG H 1.0 . 4.95 1648 1648 A 37 SER HA A 36 ARG HA 1.0 . 5.21 1649 1649 A 30 ILE HD1% A 37 SER H 1.0 . 5.00 1650 1650 A 34 ARG HA A 37 SER H 1.0 . 4.54 1651 1651 A 35 GLU HA A 37 SER H 1.0 . 0.00 1652 1652 A 34 ARG HA A 37 SER H 1.0 . 4.29 1653 1653 A 35 GLU HA A 37 SER H 1.0 . 3.89 1654 1654 A 36 ARG HA A 37 SER H 1.0 . 5.66 1655 1655 A 36 ARG HGx A 37 SER H 1.0 . 5.94 1656 1656 A 36 ARG HBy A 37 SER H 1.0 . 3.98 1657 1657 A 37 SER HBy A 37 SER H 1.0 . 3.72 1658 1658 A 37 SER HA A 37 SER H 1.0 . 3.59 1659 1659 A 37 SER HBx A 37 SER H 1.0 . 3.72 1660 1660 A 37 SER H A 38 GLU HA 1.0 . 0.00 1661 1661 A 37 SER HA A 37 SER H 1.0 . 4.28 1662 1662 A 37 SER HBy A 37 SER H 1.0 . 4.61 1663 1663 A 37 SER HBx A 37 SER H 1.0 . 5.12 1664 1664 A 37 SER H A 38 GLU HBy 1.0 . 4.69 1665 1665 A 35 GLU HBy A 37 SER H 1.0 . 0.00 1666 1666 A 37 SER H A 38 GLU H 1.0 . 4.44 1667 1667 A 37 SER H A 38 GLU H 1.0 . 3.69 1668 1668 A 35 GLU HA A 38 GLU H 1.0 . 4.76 1669 1669 A 35 GLU HA A 38 GLU H 1.0 . 3.99 1670 1670 A 37 SER HBx A 38 GLU H 1.0 . 4.18 1671 1671 A 38 GLU HA A 38 GLU H 1.0 . 0.00 1672 1672 A 37 SER HA A 38 GLU H 1.0 . 4.41 1673 1673 A 37 SER HA A 38 GLU HA 1.0 . 5.21 1674 1674 A 37 SER HBx A 38 GLU H 1.0 . 5.55 1675 1675 A 37 SER HA A 38 GLU H 1.0 . 4.38 1676 1676 A 37 SER HBy A 38 GLU H 1.0 . 5.44 1677 1677 A 38 GLU H A 38 GLU HGy 1.0 . 4.50 1678 1678 A 38 GLU HBy A 38 GLU H 1.0 . 3.69 1679 1679 A 38 GLU HA A 38 GLU HGy 1.0 . 4.34 1680 1680 A 39 GLU HGx A 38 GLU HA 1.0 . 0.00 1681 1681 A 38 GLU HA A 38 GLU HBy 1.0 . 3.69 1682 1682 A 38 GLU HA A 38 GLU HBx 1.0 . 3.63 1683 1683 A 38 GLU H A 38 GLU HBx 1.0 . 3.52 1684 1684 A 38 GLU HBy A 38 GLU H 1.0 . 3.72 1685 1685 A 38 GLU HA A 38 GLU HGy 1.0 . 4.06 1686 1686 A 38 GLU HA A 38 GLU HGy 1.0 . 4.56 1687 1687 A 38 GLU HA A 38 GLU HGy 1.0 . 4.24 1688 1688 A 38 GLU HA A 38 GLU HBy 1.0 . 4.19 1689 1689 A 38 GLU HA A 38 GLU HBx 1.0 . 3.70 1690 1690 A 38 GLU H A 38 GLU HGy 1.0 . 4.34 1691 1691 A 38 GLU H A 38 GLU HGy 1.0 . 4.34 1692 1692 A 38 GLU HA A 38 GLU H 1.0 . 3.82 1693 1693 A 38 GLU HGy A 39 GLU H 1.0 . 4.05 1694 1694 A 39 GLU H A 39 GLU HBy 1.0 . 0.00 1695 1695 A 39 GLU HGx A 39 GLU H 1.0 . 0.00 1696 1696 A 38 GLU HGy A 42 TRP HE1 1.0 . 4.35 1697 1697 A 38 GLU HGy A 42 TRP H 1.0 . 5.29 1698 1698 A 25 PHE HE% A 39 GLU HGy 1.0 . 4.28 1699 1699 A 25 PHE HBy A 25 PHE HE% 1.0 . 0.00 1700 1700 A 25 PHE HE% A 39 GLU HGy 1.0 . 5.21 1701 1701 A 25 PHE HE% A 39 GLU HBx 1.0 . 4.55 1702 1702 A 30 ILE HD1% A 39 GLU H 1.0 . 4.92 1703 1703 A 40 LEU HD21 A 39 GLU H 1.0 . 0.00 1704 1704 A 36 ARG HDx A 39 GLU HGy 1.0 . 6.37 1705 1705 A 36 ARG HDx A 39 GLU HGx 1.0 . 4.87 1706 1706 A 36 ARG HDy A 39 GLU HGy 1.0 . 6.37 1707 1707 A 39 GLU HBx A 36 ARG HA 1.0 . 5.21 1708 1708 A 39 GLU HGx A 36 ARG HA 1.0 . 3.17 1709 1709 A 39 GLU HGx A 36 ARG HA 1.0 . 4.34 1710 1710 A 39 GLU HGy A 36 ARG HA 1.0 . 3.17 1711 1711 A 36 ARG HDy A 39 GLU HBy 1.0 . 5.53 1712 1712 A 36 ARG HDy A 39 GLU HBx 1.0 . 5.46 1713 1713 A 36 ARG HA A 39 GLU HBy 1.0 . 4.65 1714 1714 A 39 GLU HBx A 36 ARG HA 1.0 . 4.61 1715 1715 A 36 ARG HDx A 39 GLU HGy 1.0 . 4.98 1716 1716 A 38 GLU HBy A 39 GLU H 1.0 . 4.95 1717 1717 A 38 GLU HA A 39 GLU H 1.0 . 4.39 1718 1718 A 38 GLU H A 39 GLU H 1.0 . 3.46 1719 1719 A 38 GLU HA A 39 GLU HA 1.0 . 6.14 1720 1720 A 38 GLU HA A 39 GLU H 1.0 . 4.69 1721 1721 A 39 GLU HGy A 39 GLU H 1.0 . 4.05 1722 1722 A 39 GLU HBx A 39 GLU H 1.0 . 4.05 1723 1723 A 39 GLU HGy A 39 GLU H 1.0 . 3.17 1724 1724 A 39 GLU HGx A 39 GLU HA 1.0 . 4.65 1725 1725 A 39 GLU HBy A 39 GLU HA 1.0 . 3.41 1726 1726 A 39 GLU HGy A 39 GLU HBy 1.0 . 3.46 1727 1727 A 39 GLU H A 39 GLU HA 1.0 . 3.39 1728 1728 A 39 GLU HBx A 39 GLU HA 1.0 . 3.15 1729 1729 A 39 GLU HBy A 39 GLU HA 1.0 . 2.99 1730 1730 A 39 GLU HGy A 39 GLU HBx 1.0 . 3.57 1731 1731 A 39 GLU HGx A 39 GLU HA 1.0 . 4.65 1732 1732 A 39 GLU HGx A 39 GLU H 1.0 . 3.17 1733 1733 A 39 GLU HBx A 39 GLU H 1.0 . 3.57 1734 1734 A 39 GLU HGy A 39 GLU HA 1.0 . 4.65 1735 1735 A 39 GLU HBx A 39 GLU HA 1.0 . 3.91 1736 1736 A 39 GLU HGy A 39 GLU HA 1.0 . 4.87 1737 1737 A 39 GLU H A 39 GLU HBy 1.0 . 3.44 1738 1738 A 39 GLU HGy A 40 LEU H 1.0 . 4.90 1739 1739 A 39 GLU HGx A 40 LEU H 1.0 . 4.54 1740 1740 A 39 GLU HGx A 40 LEU H 1.0 . 4.65 1741 1741 A 39 GLU HGy A 40 LEU H 1.0 . 4.65 1742 1742 A 41 PHE HD% A 39 GLU HBy 1.0 . 5.67 1743 1743 A 41 PHE HD% A 38 GLU HGy 1.0 . 0.00 1744 1744 A 41 PHE HD% A 39 GLU HGx 1.0 . 0.00 1745 1745 A 41 PHE HD% A 39 GLU H 1.0 . 4.90 1746 1746 A 13 PHE HZ A 40 LEU HG 1.0 . 4.33 1747 1747 A 13 PHE HZ A 40 LEU HG 1.0 . 4.72 1748 1748 A 13 PHE HD% A 40 LEU HG 1.0 . 0.00 1749 1749 A 13 PHE HZ A 40 LEU HD21 1.0 . 4.08 1750 1750 A 13 PHE HD% A 40 LEU HD21 1.0 . 0.00 1751 1751 A 15 MET HE% A 40 LEU HD21 1.0 . 3.42 1752 1752 A 15 MET HE% A 40 LEU HD21 1.0 . 3.55 1753 1753 A 15 MET HGx A 40 LEU HD21 1.0 . 4.98 1754 1754 A 25 PHE HE% A 40 LEU H 1.0 . 5.29 1755 1755 A 25 PHE HE% A 40 LEU HA 1.0 . 5.85 1756 1756 A 30 ILE HD1% A 40 LEU H 1.0 . 4.40 1757 1757 A 40 LEU H A 37 SER HA 1.0 . 4.19 1758 1758 A 40 LEU H A 37 SER HA 1.0 . 5.21 1759 1759 A 40 LEU HD21 A 37 SER HBx 1.0 . 5.21 1760 1760 A 30 ILE HD1% A 37 SER HBx 1.0 . 0.00 1761 1761 A 40 LEU H A 39 GLU HA 1.0 . 4.45 1762 1762 A 40 LEU H A 39 GLU HBy 1.0 . 4.54 1763 1763 A 39 GLU HBx A 40 LEU H 1.0 . 4.54 1764 1764 A 40 LEU H A 39 GLU HBy 1.0 . 4.65 1765 1765 A 40 LEU H A 39 GLU HA 1.0 . 3.43 1766 1766 A 39 GLU HBx A 40 LEU H 1.0 . 4.65 1767 1767 A 40 LEU HG A 40 LEU H 1.0 . 4.54 1768 1768 A 40 LEU H A 40 LEU HA 1.0 . 4.00 1769 1769 A 40 LEU H A 40 LEU HBy 1.0 . 3.91 1770 1770 A 40 LEU H A 40 LEU HBx 1.0 . 3.43 1771 1771 A 40 LEU HD21 A 40 LEU H 1.0 . 0.00 1772 1772 A 40 LEU HA A 40 LEU HBy 1.0 . 4.36 1773 1773 A 40 LEU H A 40 LEU HA 1.0 . 3.76 1774 1774 A 40 LEU HA A 40 LEU HBx 1.0 . 2.96 1775 1775 A 40 LEU HG A 40 LEU HA 1.0 . 3.82 1776 1776 A 40 LEU H A 40 LEU HBy 1.0 . 3.55 1777 1777 A 40 LEU HD21 A 40 LEU H 1.0 . 4.65 1778 1778 A 40 LEU HG A 40 LEU HD21 1.0 . 2.60 1779 1779 A 40 LEU HG A 40 LEU HBx 1.0 . 0.00 1780 1780 A 40 LEU HG A 30 ILE HD1% 1.0 . 0.00 1781 1781 A 40 LEU HG A 73 ILE HD1% 1.0 . 0.00 1782 1782 A 40 LEU HA A 40 LEU HBy 1.0 . 2.96 1783 1783 A 40 LEU HG A 40 LEU HBx 1.0 . 3.17 1784 1784 A 40 LEU HG A 40 LEU HA 1.0 . 4.20 1785 1785 A 40 LEU HD21 A 40 LEU HBy 1.0 . 3.62 1786 1786 A 40 LEU HD21 A 40 LEU HA 1.0 . 3.99 1787 1787 A 40 LEU HG A 40 LEU HD21 1.0 . 2.72 1788 1788 A 40 LEU HA A 40 LEU HBx 1.0 . 3.15 1789 1789 A 40 LEU HD21 A 40 LEU HA 1.0 . 0.00 1790 1790 A 40 LEU HG A 40 LEU H 1.0 . 4.65 1791 1791 A 40 LEU H A 40 LEU HBx 1.0 . 3.55 1792 1792 A 40 LEU HD21 A 41 PHE HE% 1.0 . 5.05 1793 1793 A 41 PHE HD% A 40 LEU H 1.0 . 4.18 1794 1794 A 40 LEU HD21 A 41 PHE HD% 1.0 . 4.72 1795 1795 A 41 PHE HD% A 40 LEU HA 1.0 . 5.05 1796 1796 A 40 LEU H A 41 PHE HE% 1.0 . 4.48 1797 1797 A 40 LEU H A 41 PHE H 1.0 . 2.89 1798 1798 A 41 PHE H A 40 LEU HBy 1.0 . 4.72 1799 1799 A 40 LEU HA A 41 PHE H 1.0 . 3.95 1800 1800 A 40 LEU H A 41 PHE HE% 1.0 . 4.45 1801 1801 A 40 LEU HD21 A 41 PHE H 1.0 . 3.89 1802 1802 A 40 LEU HD21 A 41 PHE HBx 1.0 . 5.85 1803 1803 A 40 LEU HA A 41 PHE HE% 1.0 . 5.85 1804 1804 A 40 LEU HD21 A 41 PHE H 1.0 . 3.99 1805 1805 A 40 LEU HD21 A 41 PHE HD% 1.0 . 4.65 1806 1806 A 40 LEU HD21 A 41 PHE HE% 1.0 . 5.21 1807 1807 A 40 LEU HA A 43 GLU H 1.0 . 4.15 1808 1808 A 40 LEU HD21 A 43 GLU H 1.0 . 4.95 1809 1809 A 40 LEU HD21 A 43 GLU HGx 1.0 . 5.85 1810 1810 A 43 GLU HA A 40 LEU HD21 1.0 . 6.37 1811 1811 A 40 LEU HBx A 43 GLU HBx 1.0 . 4.65 1812 1812 A 40 LEU HD21 A 43 GLU HBx 1.0 . 0.00 1813 1813 A 40 LEU HA A 43 GLU HBx 1.0 . 4.19 1814 1814 A 40 LEU HA A 43 GLU H 1.0 . 3.96 1815 1815 A 40 LEU HA A 43 GLU HBx 1.0 . 3.93 1816 1816 A 40 LEU HA A 43 GLU HBx 1.0 . 3.75 1817 1817 A 40 LEU HA A 43 GLU HGx 1.0 . 0.00 1818 1818 A 40 LEU HD21 A 43 GLU HBx 1.0 . 4.65 1819 1819 A 40 LEU HBx A 43 GLU HBx 1.0 . 4.65 1820 1820 A 40 LEU HD21 A 43 GLU HBx 1.0 . 0.00 1821 1821 A 40 LEU HD21 A 43 GLU HGx 1.0 . 5.21 1822 1822 A 40 LEU HA A 43 GLU HBx 1.0 . 3.89 1823 1823 A 40 LEU HD21 A 43 GLU HGx 1.0 . 4.65 1824 1824 A 40 LEU HD21 A 43 GLU HBx 1.0 . 0.00 1825 1825 A 40 LEU HD21 A 44 VAL H 1.0 . 4.65 1826 1826 A 40 LEU HD21 A 43 GLU H 1.0 . 0.00 1827 1827 A 40 LEU HD21 A 73 ILE HG1y 1.0 . 5.21 1828 1828 A 40 LEU HG A 73 ILE HG1y 1.0 . 5.85 1829 1829 A 41 PHE HD% A 36 ARG HBx 1.0 . 4.73 1830 1830 A 25 PHE HD% A 36 ARG HBx 1.0 . 0.00 1831 1831 A 38 GLU HA A 41 PHE HBy 1.0 . 4.60 1832 1832 A 41 PHE HBx A 38 GLU HA 1.0 . 4.22 1833 1833 A 40 LEU HBx A 41 PHE HBy 1.0 . 6.08 1834 1834 A 40 LEU HD21 A 41 PHE HBy 1.0 . 0.00 1835 1835 A 41 PHE HBx A 40 LEU HBx 1.0 . 5.85 1836 1836 A 40 LEU HD21 A 41 PHE HBx 1.0 . 0.00 1837 1837 A 41 PHE HD% A 41 PHE HE% 1.0 . 2.65 1838 1838 A 41 PHE HD% A 41 PHE HE% 1.0 . 2.96 1839 1839 A 41 PHE H A 41 PHE HA 1.0 . 3.85 1840 1840 A 41 PHE H A 41 PHE HBy 1.0 . 4.11 1841 1841 A 41 PHE HBx A 41 PHE H 1.0 . 4.20 1842 1842 A 41 PHE HBy A 41 PHE HA 1.0 . 4.35 1843 1843 A 41 PHE H A 41 PHE HBy 1.0 . 4.89 1844 1844 A 41 PHE H A 41 PHE HA 1.0 . 3.89 1845 1845 A 41 PHE HBx A 41 PHE HA 1.0 . 3.95 1846 1846 A 41 PHE HBx A 41 PHE HA 1.0 . 4.00 1847 1847 A 41 PHE HBy A 41 PHE HA 1.0 . 4.19 1848 1848 A 41 PHE HBx A 42 TRP H 1.0 . 3.96 1849 1849 A 42 TRP H A 41 PHE HBy 1.0 . 4.05 1850 1850 A 42 TRP H A 41 PHE HBy 1.0 . 5.21 1851 1851 A 41 PHE HBx A 42 TRP H 1.0 . 4.98 1852 1852 A 38 GLU HGy A 42 TRP HD1 1.0 . 3.86 1853 1853 A 38 GLU HBx A 42 TRP HD1 1.0 . 4.13 1854 1854 A 38 GLU HGy A 42 TRP HD1 1.0 . 3.86 1855 1855 A 38 GLU HA A 42 TRP H 1.0 . 4.13 1856 1856 A 38 GLU HGy A 42 TRP HD1 1.0 . 4.05 1857 1857 A 38 GLU HA A 42 TRP H 1.0 . 4.98 1858 1858 A 37 SER H A 38 GLU HA 1.0 . 0.00 1859 1859 A 38 GLU HGy A 42 TRP HD1 1.0 . 3.82 1860 1860 A 39 GLU H A 42 TRP HD1 1.0 . 4.72 1861 1861 A 39 GLU HA A 42 TRP HD1 1.0 . 3.82 1862 1862 A 42 TRP H A 39 GLU HA 1.0 . 3.94 1863 1863 A 39 GLU H A 42 TRP HD1 1.0 . 4.72 1864 1864 A 39 GLU HA A 42 TRP HBx 1.0 . 4.34 1865 1865 A 39 GLU HA A 42 TRP HD1 1.0 . 3.80 1866 1866 A 42 TRP H A 39 GLU HA 1.0 . 4.23 1867 1867 A 39 GLU HA A 42 TRP HBy 1.0 . 4.23 1868 1868 A 39 GLU HA A 42 TRP HBx 1.0 . 4.31 1869 1869 A 39 GLU HA A 42 TRP HBy 1.0 . 3.86 1870 1870 A 41 PHE HD% A 42 TRP HD1 1.0 . 5.05 1871 1871 A 42 TRP H A 41 PHE HA 1.0 . 4.13 1872 1872 A 42 TRP H A 41 PHE HA 1.0 . 5.14 1873 1873 A 42 TRP HZ2 A 42 TRP HZ3 1.0 . 5.67 1874 1874 A 42 TRP HZ2 A 42 TRP HH2 1.0 . 4.15 1875 1875 A 42 TRP HD1 A 42 TRP HBy 1.0 . 3.97 1876 1876 A 42 TRP HZ3 A 42 TRP HH2 1.0 . 3.59 1877 1877 A 42 TRP HA A 42 TRP HE3 1.0 . 4.18 1878 1878 A 42 TRP HD1 A 42 TRP HBx 1.0 . 3.80 1879 1879 A 42 TRP HZ3 A 42 TRP HE3 1.0 . 3.69 1880 1880 A 42 TRP HZ2 A 42 TRP HH2 1.0 . 3.72 1881 1881 A 42 TRP HZ3 A 42 TRP HE3 1.0 . 3.89 1882 1882 A 42 TRP HE1 A 42 TRP HD1 1.0 . 3.55 1883 1883 A 42 TRP H A 42 TRP HD1 1.0 . 4.05 1884 1884 A 42 TRP H A 42 TRP HD1 1.0 . 4.07 1885 1885 A 42 TRP H A 42 TRP HA 1.0 . 3.85 1886 1886 A 42 TRP H A 42 TRP HBx 1.0 . 3.52 1887 1887 A 42 TRP H A 42 TRP HBy 1.0 . 3.70 1888 1888 A 42 TRP HE1 A 42 TRP HD1 1.0 . 3.79 1889 1889 A 42 TRP H A 42 TRP HE3 1.0 . 5.94 1890 1890 A 42 TRP HE1 A 42 TRP HZ2 1.0 . 4.42 1891 1891 A 42 TRP H A 42 TRP HBx 1.0 . 4.05 1892 1892 A 42 TRP HBx A 42 TRP HA 1.0 . 4.22 1893 1893 A 42 TRP HBy A 42 TRP HA 1.0 . 3.96 1894 1894 A 42 TRP H A 42 TRP HA 1.0 . 3.93 1895 1895 A 42 TRP H A 42 TRP HBy 1.0 . 3.92 1896 1896 A 42 TRP HD1 A 42 TRP HBx 1.0 . 4.10 1897 1897 A 42 TRP HD1 A 42 TRP HBy 1.0 . 3.92 1898 1898 A 42 TRP HBx A 42 TRP HA 1.0 . 3.99 1899 1899 A 43 GLU HA A 42 TRP HBx 1.0 . 0.00 1900 1900 A 42 TRP H A 43 GLU H 1.0 . 3.36 1901 1901 A 42 TRP H A 43 GLU HBx 1.0 . 5.29 1902 1902 A 42 TRP H A 43 GLU HGx 1.0 . 5.29 1903 1903 A 38 GLU HGy A 42 TRP H 1.0 . 0.00 1904 1904 A 42 TRP H A 43 GLU H 1.0 . 3.63 1905 1905 A 43 GLU HA A 42 TRP HBy 1.0 . 3.63 1906 1906 A 42 TRP HBy A 42 TRP HA 1.0 . 0.00 1907 1907 A 43 GLU HA A 42 TRP HBx 1.0 . 5.21 1908 1908 A 15 MET HE% A 43 GLU H 1.0 . 5.94 1909 1909 A 42 TRP H A 43 GLU HGx 1.0 . 5.10 1910 1910 A 42 TRP H A 43 GLU HBx 1.0 . 0.00 1911 1911 A 43 GLU H A 42 TRP HBy 1.0 . 4.11 1912 1912 A 43 GLU H A 42 TRP HBx 1.0 . 4.09 1913 1913 A 43 GLU H A 42 TRP HBx 1.0 . 4.34 1914 1914 A 43 GLU H A 42 TRP HBy 1.0 . 4.11 1915 1915 A 43 GLU HA A 43 GLU H 1.0 . 3.49 1916 1916 A 43 GLU H A 43 GLU HGx 1.0 . 3.09 1917 1917 A 43 GLU H A 43 GLU HBx 1.0 . 0.00 1918 1918 A 43 GLU H A 43 GLU HGx 1.0 . 4.41 1919 1919 A 43 GLU H A 43 GLU HBx 1.0 . 3.08 1920 1920 A 43 GLU HA A 43 GLU HGx 1.0 . 3.99 1921 1921 A 43 GLU HA A 43 GLU HBx 1.0 . 3.37 1922 1922 A 43 GLU HA A 43 GLU HGx 1.0 . 3.99 1923 1923 A 43 GLU HGx A 43 GLU HBx 1.0 . 3.55 1924 1924 A 43 GLU HA A 43 GLU HBx 1.0 . 3.17 1925 1925 A 43 GLU HA A 43 GLU HGx 1.0 . 3.87 1926 1926 A 43 GLU HGx A 43 GLU HBx 1.0 . 3.55 1927 1927 A 43 GLU H A 43 GLU HBx 1.0 . 3.21 1928 1928 A 43 GLU HBx A 44 VAL H 1.0 . 0.00 1929 1929 A 43 GLU H A 43 GLU HBx 1.0 . 3.27 1930 1930 A 43 GLU HBx A 44 VAL H 1.0 . 0.00 1931 1931 A 43 GLU HA A 43 GLU HBx 1.0 . 3.55 1932 1932 A 43 GLU H A 43 GLU HGx 1.0 . 4.51 1933 1933 A 43 GLU HGx A 44 VAL H 1.0 . 0.00 1934 1934 A 43 GLU HGx A 44 VAL H 1.0 . 4.21 1935 1935 A 43 GLU HBx A 44 VAL H 1.0 . 0.00 1936 1936 A 43 GLU HA A 44 VAL H 1.0 . 4.68 1937 1937 A 43 GLU HA A 44 VAL HA 1.0 . 5.21 1938 1938 A 43 GLU HA A 44 VAL H 1.0 . 3.08 1939 1939 A 43 GLU HA A 43 GLU H 1.0 . 0.00 1940 1940 A 43 GLU HA A 46 ASP H 1.0 . 4.00 1941 1941 A 47 GLU HA A 46 ASP H 1.0 . 0.00 1942 1942 A 43 GLU H A 46 ASP HBx 1.0 . 5.04 1943 1943 A 43 GLU HA A 46 ASP HBx 1.0 . 3.64 1944 1944 A 43 GLU HA A 46 ASP HBx 1.0 . 3.99 1945 1945 A 43 GLU HA A 46 ASP HBy 1.0 . 3.99 1946 1946 A 43 GLU HA A 46 ASP HBy 1.0 . 3.37 1947 1947 A 1 MET HE% A 44 VAL HA 1.0 . 5.69 1948 1948 A 1 MET HE% A 44 VAL HGy% 1.0 . 4.02 1949 1949 A 1 MET HE% A 44 VAL HGy% 1.0 . 3.67 1950 1950 A 15 MET HE% A 44 VAL HGy% 1.0 . 5.21 1951 1951 A 44 VAL H A 41 PHE HA 1.0 . 4.54 1952 1952 A 44 VAL HGx% A 41 PHE HA 1.0 . 3.61 1953 1953 A 41 PHE HA A 44 VAL HB 1.0 . 5.21 1954 1954 A 44 VAL HGx% A 41 PHE HA 1.0 . 3.99 1955 1955 A 44 VAL HGy% A 41 PHE HA 1.0 . 5.21 1956 1956 A 44 VAL H A 41 PHE HA 1.0 . 3.92 1957 1957 A 41 PHE HA A 44 VAL HB 1.0 . 5.21 1958 1958 A 44 VAL HGx% A 43 GLU H 1.0 . 4.29 1959 1959 A 44 VAL HGy% A 43 GLU H 1.0 . 3.55 1960 1960 A 44 VAL HGy% A 44 VAL H 1.0 . 0.00 1961 1961 A 43 GLU HGx A 44 VAL H 1.0 . 4.21 1962 1962 A 43 GLU H A 43 GLU HGx 1.0 . 0.00 1963 1963 A 44 VAL H A 44 VAL HB 1.0 . 3.61 1964 1964 A 44 VAL HGx% A 44 VAL H 1.0 . 3.61 1965 1965 A 44 VAL H A 44 VAL HA 1.0 . 3.37 1966 1966 A 44 VAL HGy% A 44 VAL H 1.0 . 3.61 1967 1967 A 44 VAL H A 44 VAL HA 1.0 . 3.72 1968 1968 A 43 GLU H A 44 VAL HA 1.0 . 0.00 1969 1969 A 44 VAL HGx% A 44 VAL HA 1.0 . 3.26 1970 1970 A 44 VAL HA A 44 VAL HB 1.0 . 3.54 1971 1971 A 44 VAL H A 44 VAL HB 1.0 . 3.40 1972 1972 A 44 VAL HGy% A 44 VAL HB 1.0 . 2.82 1973 1973 A 44 VAL HGx% A 44 VAL HA 1.0 . 3.17 1974 1974 A 44 VAL HGx% A 44 VAL HB 1.0 . 3.46 1975 1975 A 44 VAL HGy% A 44 VAL HA 1.0 . 3.17 1976 1976 A 44 VAL HGx% A 44 VAL HGy% 1.0 . 3.20 1977 1977 A 44 VAL HGy% A 44 VAL HB 1.0 . 3.71 1978 1978 A 44 VAL HGx% A 44 VAL HGy% 1.0 . 3.17 1979 1979 A 44 VAL HA A 44 VAL HB 1.0 . 3.55 1980 1980 A 44 VAL HGx% A 44 VAL H 1.0 . 3.17 1981 1981 A 44 VAL HGx% A 43 GLU H 1.0 . 0.00 1982 1982 A 44 VAL HGy% A 44 VAL HA 1.0 . 3.59 1983 1983 A 44 VAL HGx% A 44 VAL HB 1.0 . 3.17 1984 1984 A 44 VAL HA A 45 MET H 1.0 . 5.01 1985 1985 A 44 VAL H A 45 MET H 1.0 . 3.23 1986 1986 A 44 VAL HGy% A 45 MET H 1.0 . 5.21 1987 1987 A 44 VAL HB A 45 MET H 1.0 . 3.45 1988 1988 A 44 VAL H A 45 MET HBy 1.0 . 5.94 1989 1989 A 44 VAL HGx% A 45 MET H 1.0 . 4.41 1990 1990 A 44 VAL HGx% A 45 MET HBy 1.0 . 3.99 1991 1991 A 15 MET HE% A 44 VAL HGx% 1.0 . 0.00 1992 1992 A 44 VAL HA A 45 MET H 1.0 . 3.70 1993 1993 A 44 VAL HGy% A 45 MET H 1.0 . 5.21 1994 1994 A 45 MET HA A 44 VAL HB 1.0 . 5.21 1995 1995 A 43 GLU HA A 44 VAL HB 1.0 . 0.00 1996 1996 A 44 VAL HB A 45 MET H 1.0 . 3.41 1997 1997 A 44 VAL HGx% A 45 MET H 1.0 . 5.21 1998 1998 A 44 VAL HA A 46 ASP H 1.0 . 4.25 1999 1999 A 44 VAL HA A 47 GLU H 1.0 . 4.55 2000 2000 A 47 GLU HGy A 44 VAL HA 1.0 . 4.65 2001 2001 A 44 VAL HA A 47 GLU H 1.0 . 4.24 2002 2002 A 47 GLU HGx A 44 VAL HA 1.0 . 3.96 2003 2003 A 47 GLU HGx A 44 VAL HA 1.0 . 4.24 2004 2004 A 44 VAL HGy% A 75 VAL HGx% 1.0 . 3.55 2005 2005 A 73 ILE HG2% A 44 VAL HGy% 1.0 . 0.00 2006 2006 A 44 VAL HGy% A 75 VAL HGx% 1.0 . 3.55 2007 2007 A 42 TRP HE3 A 45 MET HBy 1.0 . 4.50 2008 2008 A 42 TRP HA A 45 MET H 1.0 . 4.05 2009 2009 A 45 MET HA A 45 MET H 1.0 . 0.00 2010 2010 A 42 TRP HE3 A 45 MET HBy 1.0 . 5.21 2011 2011 A 45 MET H A 45 MET HBy 1.0 . 3.45 2012 2012 A 45 MET H A 45 MET HGy 1.0 . 4.12 2013 2013 A 45 MET HA A 45 MET HGy 1.0 . 4.38 2014 2014 A 45 MET H A 45 MET HBy 1.0 . 3.69 2015 2015 A 45 MET HBy A 45 MET HGy 1.0 . 3.74 2016 2016 A 45 MET HA A 45 MET HBy 1.0 . 2.97 2017 2017 A 45 MET HA A 45 MET HE% 1.0 . 3.94 2018 2018 A 45 MET HBy A 45 MET HGy 1.0 . 3.72 2019 2019 A 45 MET HA A 45 MET HGy 1.0 . 4.03 2020 2020 A 45 MET H A 45 MET HGy 1.0 . 4.41 2021 2021 A 45 MET HA A 45 MET H 1.0 . 3.51 2022 2022 A 45 MET HA A 45 MET HBy 1.0 . 3.65 2023 2023 A 45 MET HE% A 45 MET H 1.0 . 4.29 2024 2024 A 46 ASP H A 45 MET HBy 1.0 . 4.54 2025 2025 A 45 MET HA A 46 ASP H 1.0 . 4.02 2026 2026 A 46 ASP H A 45 MET H 1.0 . 3.80 2027 2027 A 46 ASP H A 45 MET HGy 1.0 . 4.76 2028 2028 A 46 ASP H A 45 MET HBy 1.0 . 4.29 2029 2029 A 45 MET HA A 46 ASP H 1.0 . 4.19 2030 2030 A 45 MET H A 47 GLU H 1.0 . 4.67 2031 2031 A 45 MET H A 47 GLU H 1.0 . 4.17 2032 2032 A 45 MET H A 48 VAL H 1.0 . 6.67 2033 2033 A 45 MET HA A 48 VAL H 1.0 . 4.26 2034 2034 A 48 VAL H A 48 VAL HA 1.0 . 0.00 2035 2035 A 45 MET HE% A 48 VAL HGy% 1.0 . 3.44 2036 2036 A 45 MET HA A 48 VAL HGy% 1.0 . 3.35 2037 2037 A 45 MET HA A 48 VAL H 1.0 . 4.37 2038 2038 A 77 LYS HEx A 45 MET HE% 1.0 . 4.66 2039 2039 A 77 LYS HEy A 45 MET HE% 1.0 . 5.04 2040 2040 A 45 MET HA A 46 ASP HA 1.0 . 4.65 2041 2041 A 47 GLU HA A 46 ASP HA 1.0 . 0.00 2042 2042 A 46 ASP H A 46 ASP HBy 1.0 . 3.61 2043 2043 A 46 ASP H A 46 ASP HA 1.0 . 3.90 2044 2044 A 46 ASP H A 46 ASP HBx 1.0 . 3.38 2045 2045 A 46 ASP HBx A 46 ASP HA 1.0 . 3.20 2046 2046 A 46 ASP HBx A 46 ASP HA 1.0 . 3.18 2047 2047 A 46 ASP H A 46 ASP HBy 1.0 . 3.19 2048 2048 A 46 ASP H A 46 ASP HA 1.0 . 3.44 2049 2049 A 46 ASP H A 46 ASP HBx 1.0 . 3.37 2050 2050 A 46 ASP HBy A 46 ASP HA 1.0 . 3.06 2051 2051 A 47 GLU H A 46 ASP HA 1.0 . 4.54 2052 2052 A 46 ASP HBx A 47 GLU H 1.0 . 4.54 2053 2053 A 46 ASP HBy A 47 GLU H 1.0 . 4.54 2054 2054 A 47 GLU H A 46 ASP HA 1.0 . 3.62 2055 2055 A 46 ASP HBy A 47 GLU H 1.0 . 3.87 2056 2056 A 46 ASP HBx A 47 GLU H 1.0 . 3.83 2057 2057 A 46 ASP HA A 49 HIS H 1.0 . 3.10 2058 2058 A 46 ASP HA A 49 HIS HBx 1.0 . 3.67 2059 2059 A 46 ASP HA A 49 HIS HBy 1.0 . 3.62 2060 2060 A 46 ASP HA A 49 HIS HBy 1.0 . 3.75 2061 2061 A 46 ASP HA A 49 HIS HBx 1.0 . 3.62 2062 2062 A 46 ASP HA A 49 HIS H 1.0 . 4.10 2063 2063 A 47 GLU HBy A 44 VAL HA 1.0 . 3.99 2064 2064 A 47 GLU HBy A 44 VAL HA 1.0 . 4.21 2065 2065 A 46 ASP H A 47 GLU H 1.0 . 3.14 2066 2066 A 47 GLU HBy A 47 GLU H 1.0 . 3.17 2067 2067 A 47 GLU HGy A 47 GLU H 1.0 . 4.05 2068 2068 A 47 GLU HA A 47 GLU H 1.0 . 3.64 2069 2069 A 47 GLU HGx A 47 GLU H 1.0 . 3.94 2070 2070 A 47 GLU HA A 47 GLU HGx 1.0 . 3.99 2071 2071 A 47 GLU HA A 47 GLU HGy 1.0 . 3.99 2072 2072 A 47 GLU HBy A 47 GLU HA 1.0 . 3.55 2073 2073 A 47 GLU HGx A 47 GLU H 1.0 . 3.99 2074 2074 A 47 GLU HBy A 47 GLU HA 1.0 . 3.17 2075 2075 A 47 GLU HA A 47 GLU HGx 1.0 . 3.99 2076 2076 A 47 GLU HA A 47 GLU HGy 1.0 . 3.99 2077 2077 A 47 GLU HA A 47 GLU H 1.0 . 3.39 2078 2078 A 47 GLU HGy A 47 GLU H 1.0 . 4.34 2079 2079 A 47 GLU HBy A 47 GLU H 1.0 . 3.27 2080 2080 A 47 GLU H A 48 VAL H 1.0 . 2.73 2081 2081 A 47 GLU HA A 48 VAL H 1.0 . 4.30 2082 2082 A 47 GLU H A 48 VAL H 1.0 . 3.58 2083 2083 A 47 GLU H A 48 VAL HGy% 1.0 . 4.46 2084 2084 A 47 GLU HGy A 48 VAL H 1.0 . 5.94 2085 2085 A 47 GLU HA A 48 VAL HGy% 1.0 . 5.21 2086 2086 A 47 GLU HBy A 48 VAL HGy% 1.0 . 4.65 2087 2087 A 47 GLU HA A 49 HIS H 1.0 . 5.94 2088 2088 A 45 MET HA A 48 VAL HB 1.0 . 3.71 2089 2089 A 48 VAL HA A 48 VAL HB 1.0 . 0.00 2090 2090 A 48 VAL H A 48 VAL HB 1.0 . 4.10 2091 2091 A 47 GLU HBy A 48 VAL H 1.0 . 0.00 2092 2092 A 48 VAL H A 48 VAL HGy% 1.0 . 4.02 2093 2093 A 48 VAL HB A 48 VAL HGx% 1.0 . 3.06 2094 2094 A 48 VAL HA A 48 VAL HGy% 1.0 . 3.55 2095 2095 A 48 VAL HA A 48 VAL HGx% 1.0 . 3.55 2096 2096 A 48 VAL HA A 48 VAL HGy% 1.0 . 3.55 2097 2097 A 48 VAL HB A 48 VAL HGx% 1.0 . 3.29 2098 2098 A 48 VAL HA A 48 VAL HGx% 1.0 . 3.59 2099 2099 A 48 VAL HGy% A 48 VAL HB 1.0 . 3.16 2100 2100 A 48 VAL HA A 48 VAL HB 1.0 . 3.55 2101 2101 A 48 VAL HA A 49 HIS H 1.0 . 3.61 2102 2102 A 48 VAL HA A 49 HIS HBy 1.0 . 5.85 2103 2103 A 45 MET HA A 49 HIS HBy 1.0 . 0.00 2104 2104 A 48 VAL HA A 49 HIS HBx 1.0 . 5.85 2105 2105 A 45 MET HA A 49 HIS HBx 1.0 . 0.00 2106 2106 A 48 VAL HA A 51 GLU H 1.0 . 4.05 2107 2107 A 48 VAL HB A 51 GLU H 1.0 . 3.23 2108 2108 A 51 GLU H A 50 GLU HBx 1.0 . 0.00 2109 2109 A 48 VAL HB A 51 GLU H 1.0 . 5.26 2110 2110 A 49 HIS H A 48 VAL HB 1.0 . 0.00 2111 2111 A 48 VAL HA A 51 GLU H 1.0 . 3.93 2112 2112 A 48 VAL HA A 49 HIS H 1.0 . 0.00 2113 2113 A 48 VAL HGy% A 49 HIS H 1.0 . 5.94 2114 2114 A 49 HIS H A 48 VAL HGx% 1.0 . 4.13 2115 2115 A 48 VAL HGx% A 49 HIS HD2 1.0 . 5.85 2116 2116 A 49 HIS HBy A 49 HIS HD2 1.0 . 3.84 2117 2117 A 49 HIS HBx A 49 HIS HD2 1.0 . 3.68 2118 2118 A 49 HIS HD2 A 49 HIS HA 1.0 . 3.44 2119 2119 A 49 HIS H A 49 HIS HBx 1.0 . 3.21 2120 2120 A 49 HIS H A 49 HIS HBy 1.0 . 3.21 2121 2121 A 49 HIS H A 49 HIS HA 1.0 . 3.10 2122 2122 A 49 HIS HBy A 49 HIS HA 1.0 . 3.67 2123 2123 A 49 HIS HBy A 49 HIS HD2 1.0 . 4.72 2124 2124 A 49 HIS HBy A 49 HIS HA 1.0 . 3.45 2125 2125 A 49 HIS HBx A 49 HIS HD2 1.0 . 4.63 2126 2126 A 49 HIS H A 49 HIS HBx 1.0 . 3.17 2127 2127 A 49 HIS HBx A 49 HIS HA 1.0 . 3.59 2128 2128 A 49 HIS HBx A 49 HIS HA 1.0 . 3.67 2129 2129 A 49 HIS H A 49 HIS HA 1.0 . 4.16 2130 2130 A 49 HIS HD2 A 49 HIS HA 1.0 . 3.17 2131 2131 A 49 HIS H A 49 HIS HBy 1.0 . 3.17 2132 2132 A 49 HIS H A 52 GLU HGx 1.0 . 5.00 2133 2133 A 49 HIS HD2 A 52 GLU HGx 1.0 . 4.27 2134 2134 A 49 HIS HA A 52 GLU HBy 1.0 . 3.55 2135 2135 A 49 HIS HA A 52 GLU HBx 1.0 . 3.55 2136 2136 A 49 HIS HD2 A 53 GLU HGy 1.0 . 5.05 2137 2137 A 49 HIS HD2 A 52 GLU HGx 1.0 . 0.00 2138 2138 A 49 HIS HA A 53 GLU HBx 1.0 . 5.21 2139 2139 A 49 HIS HD2 A 56 VAL HGy% 1.0 . 5.21 2140 2140 A 49 HIS HD2 A 56 VAL HGx% 1.0 . 5.21 2141 2141 A 50 GLU HA A 50 GLU HGy 1.0 . 3.55 2142 2142 A 50 GLU HBx A 50 GLU HA 1.0 . 3.55 2143 2143 A 50 GLU HA A 50 GLU HBy 1.0 . 3.55 2144 2144 A 50 GLU HBx A 50 GLU HA 1.0 . 3.17 2145 2145 A 51 GLU H A 50 GLU HA 1.0 . 3.35 2146 2146 A 51 GLU H A 51 GLU HA 1.0 . 0.00 2147 2147 A 51 GLU H A 50 GLU HBx 1.0 . 3.96 2148 2148 A 51 GLU H A 50 GLU HA 1.0 . 3.49 2149 2149 A 50 GLU HA A 53 GLU H 1.0 . 4.14 2150 2150 A 50 GLU HA A 53 GLU H 1.0 . 3.99 2151 2151 A 51 GLU H A 51 GLU HBy 1.0 . 3.61 2152 2152 A 51 GLU H A 51 GLU HBx 1.0 . 3.61 2153 2153 A 51 GLU H A 51 GLU HGx 1.0 . 3.40 2154 2154 A 51 GLU HA A 51 GLU HGx 1.0 . 2.80 2155 2155 A 51 GLU HA A 51 GLU HBx 1.0 . 3.55 2156 2156 A 51 GLU HA A 51 GLU HBy 1.0 . 3.55 2157 2157 A 51 GLU H A 51 GLU HGx 1.0 . 3.61 2158 2158 A 51 GLU H A 51 GLU HGy 1.0 . 4.01 2159 2159 A 51 GLU HA A 51 GLU HGy 1.0 . 2.84 2160 2160 A 51 GLU H A 51 GLU HBy 1.0 . 3.71 2161 2161 A 51 GLU H A 51 GLU HBx 1.0 . 3.91 2162 2162 A 48 VAL HGy% A 52 GLU HGx 1.0 . 4.34 2163 2163 A 51 GLU H A 52 GLU H 1.0 . 3.61 2164 2164 A 51 GLU H A 52 GLU H 1.0 . 3.59 2165 2165 A 51 GLU HA A 52 GLU H 1.0 . 3.93 2166 2166 A 52 GLU HBy A 52 GLU H 1.0 . 3.72 2167 2167 A 52 GLU HGx A 52 GLU H 1.0 . 4.02 2168 2168 A 52 GLU H A 52 GLU HA 1.0 . 3.86 2169 2169 A 52 GLU HBx A 52 GLU H 1.0 . 3.82 2170 2170 A 52 GLU HBy A 52 GLU HA 1.0 . 2.96 2171 2171 A 52 GLU HGx A 52 GLU H 1.0 . 4.65 2172 2172 A 52 GLU HBy A 52 GLU H 1.0 . 3.71 2173 2173 A 52 GLU HBx A 52 GLU HA 1.0 . 2.89 2174 2174 A 52 GLU HBx A 52 GLU H 1.0 . 4.05 2175 2175 A 52 GLU HGx A 52 GLU HA 1.0 . 3.55 2176 2176 A 52 GLU HBy A 52 GLU HA 1.0 . 3.04 2177 2177 A 52 GLU H A 52 GLU HA 1.0 . 3.90 2178 2178 A 52 GLU HBx A 52 GLU HA 1.0 . 2.92 2179 2179 A 52 GLU H A 52 GLU HGy 1.0 . 4.65 2180 2180 A 52 GLU HBy A 53 GLU H 1.0 . 4.06 2181 2181 A 53 GLU HBx A 52 GLU H 1.0 . 5.94 2182 2182 A 53 GLU HBx A 53 GLU H 1.0 . 3.37 2183 2183 A 53 GLU H A 53 GLU HA 1.0 . 3.21 2184 2184 A 53 GLU HBx A 53 GLU H 1.0 . 3.37 2185 2185 A 53 GLU HGy A 53 GLU H 1.0 . 3.37 2186 2186 A 53 GLU H A 53 GLU HA 1.0 . 3.69 2187 2187 A 53 GLU HBx A 53 GLU H 1.0 . 3.73 2188 2188 A 53 GLU H A 53 GLU HGx 1.0 . 3.87 2189 2189 A 53 GLU HGy A 53 GLU H 1.0 . 3.76 2190 2190 A 53 GLU HBx A 53 GLU H 1.0 . 3.53 2191 2191 A 54 PHE HD% A 54 PHE HA 1.0 . 4.25 2192 2192 A 54 PHE HBx A 54 PHE H 1.0 . 4.05 2193 2193 A 54 PHE HA A 54 PHE H 1.0 . 4.28 2194 2194 A 54 PHE HD% A 54 PHE HBy 1.0 . 4.17 2195 2195 A 54 PHE HA A 54 PHE HBy 1.0 . 3.17 2196 2196 A 54 PHE HA A 54 PHE HBx 1.0 . 3.17 2197 2197 A 54 PHE HD% A 54 PHE HBx 1.0 . 4.64 2198 2198 A 55 ALA HB% A 52 GLU HA 1.0 . 2.78 2199 2199 A 52 GLU HA A 55 ALA H 1.0 . 3.88 2200 2200 A 51 GLU H A 52 GLU HA 1.0 . 0.00 2201 2201 A 52 GLU HA A 54 PHE H 1.0 . 0.00 2202 2202 A 55 ALA HB% A 54 PHE H 1.0 . 3.99 2203 2203 A 54 PHE H A 55 ALA HA 1.0 . 3.48 2204 2204 A 55 ALA H A 55 ALA HA 1.0 . 0.00 2205 2205 A 55 ALA HB% A 54 PHE HD% 1.0 . 4.65 2206 2206 A 55 ALA HB% A 54 PHE HA 1.0 . 5.21 2207 2207 A 55 ALA HB% A 55 ALA H 1.0 . 3.35 2208 2208 A 55 ALA HB% A 55 ALA HA 1.0 . 3.17 2209 2209 A 55 ALA HB% A 55 ALA HA 1.0 . 2.83 2210 2210 A 55 ALA HB% A 56 VAL H 1.0 . 4.05 2211 2211 A 55 ALA HA A 56 VAL H 1.0 . 3.61 2212 2212 A 56 VAL HGy% A 55 ALA HA 1.0 . 5.85 2213 2213 A 55 ALA HB% A 56 VAL HA 1.0 . 4.65 2214 2214 A 55 ALA HA A 56 VAL HA 1.0 . 5.21 2215 2215 A 56 VAL HGx% A 55 ALA HA 1.0 . 5.85 2216 2216 A 55 ALA HA A 56 VAL H 1.0 . 4.11 2217 2217 A 55 ALA HB% A 57 GLU HGy 1.0 . 4.34 2218 2218 A 55 ALA HB% A 57 GLU HGx 1.0 . 4.34 2219 2219 A 42 TRP HH2 A 56 VAL HGy% 1.0 . 4.48 2220 2220 A 56 VAL HGx% A 56 VAL H 1.0 . 3.78 2221 2221 A 56 VAL HGx% A 56 VAL HA 1.0 . 3.19 2222 2222 A 56 VAL HGx% A 56 VAL HA 1.0 . 3.61 2223 2223 A 56 VAL HGy% A 56 VAL HA 1.0 . 3.34 2224 2224 A 56 VAL HGx% A 56 VAL HB 1.0 . 3.23 2225 2225 A 56 VAL HA A 56 VAL HB 1.0 . 3.80 2226 2226 A 56 VAL HA A 56 VAL HB 1.0 . 4.48 2227 2227 A 56 VAL HA A 57 GLU HGy 1.0 . 4.65 2228 2228 A 56 VAL HA A 57 GLU HGx 1.0 . 4.65 2229 2229 A 56 VAL HA A 58 GLY H 1.0 . 3.61 2230 2230 A 56 VAL HA A 58 GLY H 1.0 . 4.07 2231 2231 A 56 VAL HGy% A 57 GLU HA 1.0 . 5.21 2232 2232 A 56 VAL HGy% A 57 GLU HBy 1.0 . 5.85 2233 2233 A 57 GLU HA A 57 GLU HBy 1.0 . 3.51 2234 2234 A 57 GLU HA A 57 GLU HBx 1.0 . 3.54 2235 2235 A 57 GLU HA A 57 GLU HBx 1.0 . 3.11 2236 2236 A 57 GLU HGy A 57 GLU HA 1.0 . 4.65 2237 2237 A 57 GLU HGy A 57 GLU HA 1.0 . 4.34 2238 2238 A 57 GLU HGx A 57 GLU HA 1.0 . 4.65 2239 2239 A 57 GLU HGy A 57 GLU H 1.0 . 4.65 2240 2240 A 57 GLU HA A 57 GLU HBy 1.0 . 3.06 2241 2241 A 58 GLY H A 57 GLU HBy 1.0 . 4.83 2242 2242 A 57 GLU HGx A 58 GLY HAx 1.0 . 4.65 2243 2243 A 58 GLY HAx A 59 PRO HGy 1.0 . 0.00 2244 2244 A 56 VAL HGy% A 58 GLY H 1.0 . 5.07 2245 2245 A 58 GLY H A 57 GLU HA 1.0 . 3.37 2246 2246 A 57 GLU HA A 58 GLY HAy 1.0 . 5.10 2247 2247 A 58 GLY H A 57 GLU HA 1.0 . 4.01 2248 2248 A 58 GLY H A 58 GLY HAy 1.0 . 3.61 2249 2249 A 58 GLY H A 58 GLY HAx 1.0 . 3.61 2250 2250 A 58 GLY H A 59 PRO HDy 1.0 . 5.43 2251 2251 A 59 PRO HGy A 58 GLY HAy 1.0 . 4.65 2252 2252 A 57 GLU HBx A 58 GLY HAy 1.0 . 0.00 2253 2253 A 58 GLY HAx A 59 PRO HDy 1.0 . 3.24 2254 2254 A 58 GLY HAy A 59 PRO HDy 1.0 . 3.32 2255 2255 A 58 GLY HAx A 59 PRO HDy 1.0 . 3.33 2256 2256 A 58 GLY HAy A 59 PRO HDy 1.0 . 3.22 2257 2257 A 59 PRO HGy A 59 PRO HBx 1.0 . 3.35 2258 2258 A 59 PRO HA A 59 PRO HBy 1.0 . 2.96 2259 2259 A 59 PRO HDy A 59 PRO HBx 1.0 . 3.90 2260 2260 A 59 PRO HBx A 59 PRO HA 1.0 . 2.96 2261 2261 A 59 PRO HGy A 59 PRO HA 1.0 . 4.05 2262 2262 A 59 PRO HGy A 59 PRO HDy 1.0 . 3.14 2263 2263 A 59 PRO HDy A 59 PRO HBy 1.0 . 4.33 2264 2264 A 59 PRO HA A 59 PRO HBy 1.0 . 3.94 2265 2265 A 59 PRO HDy A 59 PRO HA 1.0 . 4.14 2266 2266 A 59 PRO HGy A 59 PRO HA 1.0 . 3.99 2267 2267 A 59 PRO HGy A 59 PRO HBy 1.0 . 3.50 2268 2268 A 59 PRO HDy A 59 PRO HBx 1.0 . 4.14 2269 2269 A 59 PRO HBx A 59 PRO HA 1.0 . 3.81 2270 2270 A 59 PRO HGy A 59 PRO HBx 1.0 . 2.98 2271 2271 A 59 PRO HDy A 59 PRO HBy 1.0 . 3.86 2272 2272 A 59 PRO HDy A 59 PRO HA 1.0 . 4.61 2273 2273 A 59 PRO HGy A 59 PRO HDy 1.0 . 2.96 2274 2274 A 59 PRO HGy A 60 LEU H 1.0 . 4.97 2275 2275 A 59 PRO HA A 60 LEU H 1.0 . 3.00 2276 2276 A 59 PRO HA A 60 LEU H 1.0 . 2.96 2277 2277 A 60 LEU H A 60 LEU HBy 1.0 . 3.37 2278 2278 A 60 LEU H A 60 LEU HBy 1.0 . 3.55 2279 2279 A 59 PRO HGy A 61 TRP HE1 1.0 . 3.61 2280 2280 A 59 PRO HGy A 61 TRP HD1 1.0 . 5.10 2281 2281 A 61 TRP HA A 60 LEU HBx 1.0 . 4.58 2282 2282 A 61 TRP HE1 A 61 TRP HZ2 1.0 . 5.56 2283 2283 A 61 TRP HZ2 A 61 TRP HZ3 1.0 . 4.87 2284 2284 A 61 TRP HZ3 A 61 TRP HE3 1.0 . 3.77 2285 2285 A 61 TRP HE3 A 61 TRP HBx 1.0 . 5.05 2286 2286 A 61 TRP HA A 61 TRP HD1 1.0 . 4.22 2287 2287 A 61 TRP HE3 A 61 TRP HBy 1.0 . 5.05 2288 2288 A 61 TRP HE1 A 61 TRP HD1 1.0 . 3.06 2289 2289 A 61 TRP HD1 A 61 TRP HBx 1.0 . 3.86 2290 2290 A 61 TRP HD1 A 61 TRP HBy 1.0 . 3.86 2291 2291 A 61 TRP HA A 61 TRP HE1 1.0 . 5.82 2292 2292 A 61 TRP HE1 A 61 TRP HZ2 1.0 . 4.30 2293 2293 A 61 TRP HA A 61 TRP H 1.0 . 4.32 2294 2294 A 61 TRP HE1 A 61 TRP HD1 1.0 . 2.86 2295 2295 A 61 TRP HD1 A 61 TRP HBx 1.0 . 3.99 2296 2296 A 61 TRP HE3 A 61 TRP HBx 1.0 . 3.99 2297 2297 A 61 TRP HA A 61 TRP HD1 1.0 . 4.97 2298 2298 A 61 TRP HA A 61 TRP HBy 1.0 . 3.17 2299 2299 A 61 TRP HA A 61 TRP HBx 1.0 . 3.17 2300 2300 A 61 TRP HE3 A 61 TRP HBy 1.0 . 3.99 2301 2301 A 61 TRP HD1 A 61 TRP HBy 1.0 . 3.99 2302 2302 A 76 THR HB A 61 TRP HD1 1.0 . 5.16 2303 2303 A 76 THR HG2% A 61 TRP HBx 1.0 . 3.54 2304 2304 A 76 THR HG2% A 61 TRP HBx 1.0 . 3.55 2305 2305 A 76 THR HB A 61 TRP HBy 1.0 . 4.65 2306 2306 A 76 THR HA A 61 TRP HD1 1.0 . 5.85 2307 2307 A 76 THR HB A 61 TRP HBx 1.0 . 5.21 2308 2308 A 76 THR HG2% A 61 TRP HBy 1.0 . 3.72 2309 2309 A 76 THR HG2% A 61 TRP HBy 1.0 . 3.55 2310 2310 A 76 THR HB A 61 TRP HBx 1.0 . 4.65 2311 2311 A 76 THR HB A 61 TRP HD1 1.0 . 5.02 2312 2312 A 77 LYS HGy A 61 TRP HD1 1.0 . 4.65 2313 2313 A 77 LYS HDy A 61 TRP HD1 1.0 . 5.11 2314 2314 A 77 LYS HGx A 61 TRP HD1 1.0 . 4.55 2315 2315 A 61 TRP HD1 A 78 ALA HB% 1.0 . 5.01 2316 2316 A 61 TRP HE1 A 78 ALA HB% 1.0 . 4.05 2317 2317 A 62 ILE HG2% A 62 ILE HB 1.0 . 4.05 2318 2318 A 62 ILE HG2% A 62 ILE HB 1.0 . 3.46 2319 2319 A 75 VAL HGx% A 62 ILE HD1% 1.0 . 3.55 2320 2320 A 62 ILE HG2% A 75 VAL HGy% 1.0 . 4.17 2321 2321 A 62 ILE HD1% A 75 VAL HGy% 1.0 . 3.61 2322 2322 A 75 VAL HGx% A 62 ILE HG2% 1.0 . 2.87 2323 2323 A 62 ILE HB A 63 GLN H 1.0 . 4.93 2324 2324 A 62 ILE HG2% A 63 GLN H 1.0 . 4.85 2325 2325 A 62 ILE HB A 63 GLN H 1.0 . 5.06 2326 2326 A 63 GLN HE2x A 63 GLN HGx 1.0 . 4.40 2327 2327 A 63 GLN H A 63 GLN HA 1.0 . 4.16 2328 2328 A 63 GLN HBy A 63 GLN HE2y 1.0 . 3.89 2329 2329 A 63 GLN H A 63 GLN HBy 1.0 . 4.53 2330 2330 A 63 GLN HE2x A 63 GLN HBy 1.0 . 4.42 2331 2331 A 63 GLN HA A 63 GLN HBy 1.0 . 3.30 2332 2332 A 63 GLN H A 63 GLN HGx 1.0 . 4.93 2333 2333 A 63 GLN HE2x A 63 GLN HGx 1.0 . 4.48 2334 2334 A 63 GLN HGx A 63 GLN HA 1.0 . 3.99 2335 2335 A 63 GLN HA A 63 GLN HGy 1.0 . 4.48 2336 2336 A 63 GLN H A 63 GLN HA 1.0 . 4.92 2337 2337 A 63 GLN HGx A 63 GLN HE2y 1.0 . 4.72 2338 2338 A 63 GLN HE2x A 63 GLN HGy 1.0 . 5.23 2339 2339 A 63 GLN HBy A 64 VAL H 1.0 . 4.46 2340 2340 A 63 GLN HA A 64 VAL H 1.0 . 2.76 2341 2341 A 63 GLN H A 64 VAL HGx% 1.0 . 5.29 2342 2342 A 63 GLN HA A 64 VAL H 1.0 . 2.72 2343 2343 A 63 GLN HA A 64 VAL HGx% 1.0 . 4.12 2344 2344 A 73 ILE HG2% A 63 GLN H 1.0 . 4.50 2345 2345 A 63 GLN H A 75 VAL HA 1.0 . 4.16 2346 2346 A 75 VAL H A 63 GLN H 1.0 . 4.94 2347 2347 A 63 GLN H A 75 VAL HA 1.0 . 3.55 2348 2348 A 76 THR HG2% A 63 GLN H 1.0 . 4.04 2349 2349 A 31 TRP HH2 A 64 VAL HA 1.0 . 4.72 2350 2350 A 31 TRP HZ3 A 64 VAL HGy% 1.0 . 3.86 2351 2351 A 31 TRP HZ3 A 64 VAL HGy% 1.0 . 3.87 2352 2352 A 31 TRP HZ3 A 64 VAL HGx% 1.0 . 3.87 2353 2353 A 63 GLN HGx A 64 VAL H 1.0 . 5.21 2354 2354 A 64 VAL H A 64 VAL HGy% 1.0 . 4.05 2355 2355 A 64 VAL H A 64 VAL HB 1.0 . 3.61 2356 2356 A 64 VAL H A 64 VAL HGx% 1.0 . 4.05 2357 2357 A 64 VAL H A 64 VAL HB 1.0 . 3.55 2358 2358 A 64 VAL HGx% A 64 VAL HA 1.0 . 3.55 2359 2359 A 64 VAL HA A 64 VAL HGy% 1.0 . 3.55 2360 2360 A 64 VAL HGy% A 64 VAL HB 1.0 . 2.42 2361 2361 A 64 VAL H A 64 VAL HGx% 1.0 . 3.99 2362 2362 A 64 VAL HGx% A 64 VAL HA 1.0 . 3.55 2363 2363 A 64 VAL HGx% A 64 VAL HB 1.0 . 2.42 2364 2364 A 64 VAL HA A 65 GLN HE2y 1.0 . 4.89 2365 2365 A 64 VAL HGy% A 65 GLN H 1.0 . 4.05 2366 2366 A 64 VAL HA A 65 GLN HE2x 1.0 . 4.21 2367 2367 A 64 VAL HB A 65 GLN H 1.0 . 4.68 2368 2368 A 64 VAL HGx% A 65 GLN H 1.0 . 4.05 2369 2369 A 64 VAL H A 65 GLN H 1.0 . 4.90 2370 2370 A 64 VAL HGx% A 65 GLN HE2x 1.0 . 5.94 2371 2371 A 64 VAL HA A 65 GLN H 1.0 . 2.76 2372 2372 A 64 VAL HGy% A 65 GLN H 1.0 . 3.99 2373 2373 A 64 VAL HA A 65 GLN H 1.0 . 2.82 2374 2374 A 64 VAL HGx% A 65 GLN H 1.0 . 3.99 2375 2375 A 64 VAL HB A 65 GLN H 1.0 . 5.05 2376 2376 A 64 VAL HGx% A 66 ALA H 1.0 . 4.64 2377 2377 A 72 GLU H A 64 VAL HGy% 1.0 . 5.94 2378 2378 A 72 GLU H A 64 VAL HA 1.0 . 4.04 2379 2379 A 72 GLU H A 66 ALA HA 1.0 . 0.00 2380 2380 A 73 ILE H A 64 VAL HGy% 1.0 . 5.94 2381 2381 A 73 ILE HG1x A 64 VAL HGy% 1.0 . 3.55 2382 2382 A 64 VAL HGy% A 73 ILE HA 1.0 . 3.92 2383 2383 A 64 VAL HGx% A 73 ILE HA 1.0 . 3.96 2384 2384 A 63 GLN HA A 64 VAL HGx% 1.0 . 0.00 2385 2385 A 73 ILE HG1y A 64 VAL HGy% 1.0 . 3.34 2386 2386 A 40 LEU HG A 73 ILE HG1y 1.0 . 0.00 2387 2387 A 64 VAL HGy% A 74 ILE H 1.0 . 5.94 2388 2388 A 65 GLN HE2x A 65 GLN HBy 1.0 . 5.29 2389 2389 A 65 GLN HE2y A 65 GLN HBx 1.0 . 5.29 2390 2390 A 65 GLN HE2x A 65 GLN HGy 1.0 . 4.28 2391 2391 A 65 GLN H A 65 GLN HGy 1.0 . 4.55 2392 2392 A 65 GLN H A 65 GLN HBy 1.0 . 3.70 2393 2393 A 65 GLN HE2x A 65 GLN HBx 1.0 . 5.29 2394 2394 A 65 GLN HE2y A 65 GLN HGy 1.0 . 4.16 2395 2395 A 65 GLN H A 65 GLN HBx 1.0 . 3.76 2396 2396 A 65 GLN HE2x A 65 GLN HGy 1.0 . 4.19 2397 2397 A 65 GLN HE2y A 65 GLN HGy 1.0 . 3.89 2398 2398 A 65 GLN H A 65 GLN HBy 1.0 . 4.26 2399 2399 A 65 GLN H A 65 GLN HGy 1.0 . 4.31 2400 2400 A 65 GLN H A 65 GLN HBx 1.0 . 4.08 2401 2401 A 65 GLN H A 67 LEU HDx% 1.0 . 5.94 2402 2402 A 67 LEU HDy% A 65 GLN H 1.0 . 5.94 2403 2403 A 65 GLN H A 71 LEU HA 1.0 . 4.37 2404 2404 A 65 GLN H A 71 LEU HA 1.0 . 6.37 2405 2405 A 72 GLU HA A 65 GLN H 1.0 . 4.95 2406 2406 A 72 GLU HBy A 65 GLN HE2y 1.0 . 4.54 2407 2407 A 72 GLU HBy A 65 GLN H 1.0 . 4.54 2408 2408 A 72 GLU H A 65 GLN H 1.0 . 4.06 2409 2409 A 73 ILE H A 65 GLN H 1.0 . 0.00 2410 2410 A 72 GLU H A 65 GLN H 1.0 . 3.48 2411 2411 A 65 GLN H A 73 ILE HA 1.0 . 4.34 2412 2412 A 73 ILE H A 65 GLN H 1.0 . 4.95 2413 2413 A 73 ILE HD1% A 65 GLN H 1.0 . 4.01 2414 2414 A 73 ILE HG2% A 65 GLN H 1.0 . 0.00 2415 2415 A 73 ILE HD1% A 65 GLN H 1.0 . 4.63 2416 2416 A 65 GLN H A 73 ILE HA 1.0 . 5.17 2417 2417 A 74 ILE HD1% A 65 GLN HE2y 1.0 . 4.34 2418 2418 A 74 ILE HD1% A 65 GLN HE2x 1.0 . 4.14 2419 2419 A 66 ALA HB% A 31 TRP HZ2 1.0 . 5.05 2420 2420 A 66 ALA HB% A 31 TRP HE1 1.0 . 4.77 2421 2421 A 66 ALA HB% A 31 TRP HE1 1.0 . 4.46 2422 2422 A 66 ALA H A 65 GLN HGy 1.0 . 4.72 2423 2423 A 66 ALA H A 65 GLN HBx 1.0 . 4.00 2424 2424 A 66 ALA H A 65 GLN HBy 1.0 . 3.94 2425 2425 A 66 ALA H A 65 GLN HBx 1.0 . 3.99 2426 2426 A 66 ALA H A 65 GLN HGy 1.0 . 4.65 2427 2427 A 66 ALA H A 65 GLN HBy 1.0 . 4.03 2428 2428 A 66 ALA H A 66 ALA HA 1.0 . 3.34 2429 2429 A 66 ALA HB% A 66 ALA H 1.0 . 3.52 2430 2430 A 66 ALA H A 66 ALA HA 1.0 . 3.78 2431 2431 A 66 ALA HB% A 66 ALA HA 1.0 . 3.37 2432 2432 A 66 ALA HB% A 66 ALA H 1.0 . 3.47 2433 2433 A 66 ALA HB% A 66 ALA HA 1.0 . 3.31 2434 2434 A 71 LEU HDx% A 66 ALA HA 1.0 . 4.34 2435 2435 A 67 LEU HDy% A 66 ALA HA 1.0 . 0.00 2436 2436 A 71 LEU HDx% A 66 ALA HA 1.0 . 4.65 2437 2437 A 71 LEU HDx% A 66 ALA HB% 1.0 . 3.99 2438 2438 A 66 ALA HB% A 67 LEU HDx% 1.0 . 0.00 2439 2439 A 14 TYR HD% A 67 LEU HDx% 1.0 . 4.33 2440 2440 A 14 TYR HE% A 67 LEU HDx% 1.0 . 3.86 2441 2441 A 14 TYR HE% A 67 LEU HBx 1.0 . 3.90 2442 2442 A 14 TYR HE% A 67 LEU HBy 1.0 . 3.62 2443 2443 A 67 LEU HDy% A 14 TYR HE% 1.0 . 4.11 2444 2444 A 71 LEU HDx% A 14 TYR HE% 1.0 . 0.00 2445 2445 A 14 TYR HE% A 67 LEU HBy 1.0 . 4.98 2446 2446 A 14 TYR HE% A 67 LEU HBx 1.0 . 5.81 2447 2447 A 65 GLN HE2y A 67 LEU HDx% 1.0 . 5.94 2448 2448 A 65 GLN HE2x A 67 LEU HDx% 1.0 . 5.29 2449 2449 A 65 GLN HGy A 67 LEU HDx% 1.0 . 4.65 2450 2450 A 65 GLN HBy A 67 LEU HDx% 1.0 . 5.21 2451 2451 A 65 GLN HBx A 67 LEU HDx% 1.0 . 5.21 2452 2452 A 66 ALA H A 67 LEU H 1.0 . 4.54 2453 2453 A 66 ALA HA A 67 LEU H 1.0 . 3.16 2454 2454 A 66 ALA H A 67 LEU H 1.0 . 4.54 2455 2455 A 66 ALA HB% A 67 LEU H 1.0 . 3.59 2456 2456 A 66 ALA H A 67 LEU HDx% 1.0 . 4.52 2457 2457 A 66 ALA HA A 67 LEU HDx% 1.0 . 3.99 2458 2458 A 66 ALA HB% A 67 LEU H 1.0 . 3.79 2459 2459 A 66 ALA HA A 67 LEU H 1.0 . 3.51 2460 2460 A 67 LEU HBy A 67 LEU H 1.0 . 3.76 2461 2461 A 67 LEU HBx A 67 LEU H 1.0 . 3.48 2462 2462 A 67 LEU H A 67 LEU HG 1.0 . 3.57 2463 2463 A 67 LEU HDx% A 67 LEU H 1.0 . 4.41 2464 2464 A 67 LEU HDx% A 67 LEU HBy 1.0 . 3.09 2465 2465 A 67 LEU HBy A 67 LEU H 1.0 . 4.30 2466 2466 A 67 LEU HBy A 68 ASP H 1.0 . 0.00 2467 2467 A 67 LEU HDx% A 67 LEU H 1.0 . 4.34 2468 2468 A 67 LEU HDy% A 67 LEU H 1.0 . 4.34 2469 2469 A 67 LEU HDx% A 67 LEU HG 1.0 . 2.68 2470 2470 A 67 LEU HBx A 67 LEU H 1.0 . 4.27 2471 2471 A 67 LEU HBx A 68 ASP H 1.0 . 0.00 2472 2472 A 67 LEU HDy% A 67 LEU HBy 1.0 . 2.75 2473 2473 A 67 LEU H A 67 LEU HG 1.0 . 3.55 2474 2474 A 67 LEU HDx% A 67 LEU HBx 1.0 . 3.33 2475 2475 A 67 LEU HDx% A 67 LEU HG 1.0 . 3.55 2476 2476 A 67 LEU HDx% A 68 ASP H 1.0 . 5.72 2477 2477 A 68 ASP HA A 67 LEU HDx% 1.0 . 6.37 2478 2478 A 70 GLY H A 67 LEU H 1.0 . 5.15 2479 2479 A 70 GLY H A 67 LEU HBy 1.0 . 4.54 2480 2480 A 70 GLY H A 67 LEU HBx 1.0 . 4.54 2481 2481 A 70 GLY H A 67 LEU H 1.0 . 4.19 2482 2482 A 70 GLY H A 67 LEU HBy 1.0 . 4.70 2483 2483 A 70 GLY H A 67 LEU HBx 1.0 . 5.48 2484 2484 A 71 LEU HA A 67 LEU H 1.0 . 4.01 2485 2485 A 71 LEU H A 67 LEU H 1.0 . 4.95 2486 2486 A 71 LEU HA A 67 LEU HG 1.0 . 4.43 2487 2487 A 71 LEU HA A 67 LEU HBy 1.0 . 5.21 2488 2488 A 71 LEU HA A 67 LEU HG 1.0 . 4.37 2489 2489 A 71 LEU HA A 67 LEU H 1.0 . 4.08 2490 2490 A 72 GLU H A 67 LEU H 1.0 . 4.40 2491 2491 A 72 GLU H A 67 LEU HG 1.0 . 4.54 2492 2492 A 72 GLU HBy A 67 LEU HDx% 1.0 . 5.85 2493 2493 A 72 GLU HGx A 67 LEU HDx% 1.0 . 5.21 2494 2494 A 72 GLU H A 67 LEU HG 1.0 . 4.24 2495 2495 A 72 GLU HBx A 67 LEU HDx% 1.0 . 5.85 2496 2496 A 72 GLU HGy A 67 LEU HDx% 1.0 . 5.21 2497 2497 A 68 ASP H A 68 ASP HBy 1.0 . 5.46 2498 2498 A 68 ASP HA A 68 ASP HBy 1.0 . 3.55 2499 2499 A 68 ASP HA A 68 ASP HBy 1.0 . 3.77 2500 2500 A 69 LYS HGx A 68 ASP HBy 1.0 . 5.21 2501 2501 A 68 ASP HA A 69 LYS HGx 1.0 . 6.08 2502 2502 A 69 LYS HGx A 68 ASP HBy 1.0 . 4.65 2503 2503 A 69 LYS HGy A 68 ASP HBy 1.0 . 5.21 2504 2504 A 69 LYS HDx A 69 LYS HGy 1.0 . 4.34 2505 2505 A 69 LYS HBx A 69 LYS HGy 1.0 . 0.00 2506 2506 A 69 LYS HDy A 69 LYS HEy 1.0 . 3.99 2507 2507 A 69 LYS HA A 69 LYS HEy 1.0 . 6.08 2508 2508 A 69 LYS HGx A 69 LYS HDx 1.0 . 3.99 2509 2509 A 69 LYS HA A 69 LYS HGy 1.0 . 5.21 2510 2510 A 69 LYS HA A 69 LYS HEy 1.0 . 5.42 2511 2511 A 69 LYS HBy A 69 LYS HGy 1.0 . 5.21 2512 2512 A 69 LYS HA A 69 LYS HDx 1.0 . 3.79 2513 2513 A 69 LYS HA A 69 LYS HDx 1.0 . 3.07 2514 2514 A 69 LYS HA A 69 LYS HBx 1.0 . 0.00 2515 2515 A 69 LYS HGx A 69 LYS HEy 1.0 . 5.21 2516 2516 A 69 LYS HA A 69 LYS HDy 1.0 . 4.03 2517 2517 A 69 LYS HDx A 69 LYS HEy 1.0 . 3.55 2518 2518 A 69 LYS HGx A 69 LYS HA 1.0 . 5.21 2519 2519 A 69 LYS HGx A 69 LYS HBx 1.0 . 3.17 2520 2520 A 69 LYS HBx A 69 LYS HEy 1.0 . 4.14 2521 2521 A 69 LYS HDx A 69 LYS HEy 1.0 . 0.00 2522 2522 A 69 LYS HGx A 69 LYS HDx 1.0 . 4.34 2523 2523 A 69 LYS HGx A 69 LYS HBx 1.0 . 0.00 2524 2524 A 69 LYS HGy A 69 LYS HEy 1.0 . 5.21 2525 2525 A 69 LYS HA A 69 LYS HBx 1.0 . 3.49 2526 2526 A 69 LYS HGy A 69 LYS HDy 1.0 . 4.34 2527 2527 A 69 LYS HA A 69 LYS HDy 1.0 . 3.06 2528 2528 A 69 LYS HGx A 69 LYS HDy 1.0 . 4.34 2529 2529 A 69 LYS HBy A 69 LYS HGx 1.0 . 5.21 2530 2530 A 69 LYS HBy A 69 LYS HGx 1.0 . 3.21 2531 2531 A 69 LYS HDy A 69 LYS HEy 1.0 . 3.55 2532 2532 A 69 LYS HGx A 69 LYS HA 1.0 . 3.99 2533 2533 A 69 LYS HBy A 69 LYS HA 1.0 . 3.42 2534 2534 A 69 LYS HBy A 69 LYS HA 1.0 . 3.49 2535 2535 A 69 LYS HGx A 69 LYS HEy 1.0 . 4.34 2536 2536 A 14 TYR HE% A 70 GLY H 1.0 . 4.72 2537 2537 A 14 TYR HE% A 70 GLY HAy 1.0 . 5.67 2538 2538 A 14 TYR HE% A 70 GLY HAx 1.0 . 4.44 2539 2539 A 14 TYR HE% A 70 GLY H 1.0 . 4.55 2540 2540 A 14 TYR HE% A 70 GLY HAy 1.0 . 4.85 2541 2541 A 14 TYR HE% A 70 GLY HAx 1.0 . 4.97 2542 2542 A 16 SER HBx A 70 GLY HAx 1.0 . 5.21 2543 2543 A 16 SER HBy A 70 GLY HAy 1.0 . 5.21 2544 2544 A 16 SER HBy A 70 GLY HAx 1.0 . 5.21 2545 2545 A 16 SER HBy A 70 GLY HAy 1.0 . 5.21 2546 2546 A 16 SER HBx A 70 GLY HAy 1.0 . 5.21 2547 2547 A 16 SER HBx A 70 GLY HAx 1.0 . 5.21 2548 2548 A 1 MET HBy A 16 SER HBx 1.0 . 0.00 2549 2549 A 2 GLU HBx A 16 SER HBx 1.0 . 0.00 2550 2550 A 70 GLY H A 66 ALA HB% 1.0 . 5.85 2551 2551 A 70 GLY H A 68 ASP HBy 1.0 . 5.94 2552 2552 A 70 GLY H A 69 LYS HGx 1.0 . 5.94 2553 2553 A 70 GLY H A 69 LYS HA 1.0 . 3.83 2554 2554 A 70 GLY H A 69 LYS HGy 1.0 . 5.94 2555 2555 A 70 GLY HAx A 70 GLY H 1.0 . 3.76 2556 2556 A 70 GLY H A 69 LYS HBy 1.0 . 0.00 2557 2557 A 70 GLY H A 70 GLY HAy 1.0 . 4.28 2558 2558 A 70 GLY HAx A 70 GLY H 1.0 . 4.24 2559 2559 A 70 GLY H A 70 GLY HAy 1.0 . 4.62 2560 2560 A 70 GLY HAx A 71 LEU H 1.0 . 5.48 2561 2561 A 70 GLY H A 71 LEU H 1.0 . 5.25 2562 2562 A 70 GLY HAy A 71 LEU H 1.0 . 4.94 2563 2563 A 71 LEU HDx% A 70 GLY H 1.0 . 4.09 2564 2564 A 70 GLY H A 67 LEU HDx% 1.0 . 0.00 2565 2565 A 71 LEU HDx% A 70 GLY HAx 1.0 . 5.21 2566 2566 A 70 GLY HAx A 67 LEU HDx% 1.0 . 0.00 2567 2567 A 70 GLY HAy A 71 LEU H 1.0 . 4.26 2568 2568 A 70 GLY HAx A 71 LEU H 1.0 . 4.38 2569 2569 A 70 GLY HAy A 71 LEU HA 1.0 . 5.10 2570 2570 A 71 LEU HDx% A 31 TRP HZ2 1.0 . 3.06 2571 2571 A 66 ALA H A 71 LEU HA 1.0 . 5.29 2572 2572 A 66 ALA H A 71 LEU HA 1.0 . 5.21 2573 2573 A 66 ALA HB% A 71 LEU HA 1.0 . 4.34 2574 2574 A 66 ALA HA A 71 LEU HA 1.0 . 3.55 2575 2575 A 66 ALA HA A 71 LEU HA 1.0 . 3.56 2576 2576 A 66 ALA HB% A 71 LEU HA 1.0 . 4.31 2577 2577 A 71 LEU HG A 71 LEU H 1.0 . 4.87 2578 2578 A 71 LEU HDx% A 71 LEU H 1.0 . 5.04 2579 2579 A 71 LEU H A 71 LEU HBx 1.0 . 4.81 2580 2580 A 71 LEU H A 71 LEU HBy 1.0 . 5.66 2581 2581 A 71 LEU HDx% A 71 LEU HA 1.0 . 4.34 2582 2582 A 67 LEU HDy% A 71 LEU HA 1.0 . 0.00 2583 2583 A 71 LEU HDx% A 71 LEU HA 1.0 . 4.52 2584 2584 A 71 LEU H A 71 LEU HBx 1.0 . 5.11 2585 2585 A 71 LEU HA A 71 LEU HBx 1.0 . 3.56 2586 2586 A 71 LEU HDx% A 71 LEU HBy 1.0 . 3.63 2587 2587 A 71 LEU HG A 71 LEU HA 1.0 . 5.09 2588 2588 A 71 LEU HDx% A 71 LEU HA 1.0 . 4.34 2589 2589 A 71 LEU HA A 71 LEU HBx 1.0 . 4.21 2590 2590 A 71 LEU HA A 71 LEU HBy 1.0 . 3.66 2591 2591 A 71 LEU HDx% A 71 LEU HBx 1.0 . 3.40 2592 2592 A 71 LEU H A 71 LEU HA 1.0 . 6.17 2593 2593 A 71 LEU HDx% A 71 LEU HA 1.0 . 4.34 2594 2594 A 67 LEU HDy% A 71 LEU HA 1.0 . 0.00 2595 2595 A 71 LEU HDx% A 71 LEU HG 1.0 . 3.32 2596 2596 A 71 LEU HDx% A 71 LEU HG 1.0 . 3.05 2597 2597 A 71 LEU HG A 71 LEU HA 1.0 . 4.65 2598 2598 A 71 LEU HDx% A 71 LEU HG 1.0 . 3.33 2599 2599 A 71 LEU HA A 71 LEU HBy 1.0 . 4.69 2600 2600 A 71 LEU HG A 71 LEU HBy 1.0 . 3.61 2601 2601 A 71 LEU HDx% A 71 LEU HBy 1.0 . 3.96 2602 2602 A 71 LEU HG A 71 LEU HBx 1.0 . 3.41 2603 2603 A 71 LEU HDx% A 71 LEU HBx 1.0 . 3.74 2604 2604 A 72 GLU H A 71 LEU HBx 1.0 . 4.05 2605 2605 A 72 GLU H A 71 LEU HBy 1.0 . 4.05 2606 2606 A 72 GLU H A 71 LEU HBx 1.0 . 4.52 2607 2607 A 72 GLU H A 71 LEU HBy 1.0 . 5.20 2608 2608 A 72 GLU HBx A 71 LEU HA 1.0 . 5.85 2609 2609 A 73 ILE HD1% A 71 LEU HBx 1.0 . 3.67 2610 2610 A 15 MET H A 72 GLU H 1.0 . 4.77 2611 2611 A 72 GLU H A 65 GLN HGy 1.0 . 5.29 2612 2612 A 72 GLU H A 65 GLN HBx 1.0 . 5.94 2613 2613 A 71 LEU HDx% A 72 GLU H 1.0 . 4.72 2614 2614 A 72 GLU H A 67 LEU HDx% 1.0 . 0.00 2615 2615 A 71 LEU HDx% A 72 GLU H 1.0 . 4.95 2616 2616 A 72 GLU H A 71 LEU HA 1.0 . 3.38 2617 2617 A 72 GLU HA A 72 GLU H 1.0 . 3.27 2618 2618 A 72 GLU HBy A 72 GLU H 1.0 . 3.33 2619 2619 A 72 GLU HBx A 72 GLU H 1.0 . 3.87 2620 2620 A 73 ILE H A 72 GLU HBx 1.0 . 0.00 2621 2621 A 72 GLU HA A 72 GLU HBx 1.0 . 3.54 2622 2622 A 72 GLU HA A 72 GLU H 1.0 . 2.72 2623 2623 A 72 GLU HA A 73 ILE H 1.0 . 0.00 2624 2624 A 72 GLU HA A 72 GLU HBy 1.0 . 3.92 2625 2625 A 72 GLU HBy A 72 GLU H 1.0 . 4.04 2626 2626 A 73 ILE H A 72 GLU HBy 1.0 . 0.00 2627 2627 A 72 GLU HGy A 72 GLU HA 1.0 . 4.21 2628 2628 A 72 GLU HA A 72 GLU HBx 1.0 . 3.91 2629 2629 A 72 GLU HA A 72 GLU HGx 1.0 . 4.29 2630 2630 A 72 GLU HA A 72 GLU HBy 1.0 . 3.61 2631 2631 A 72 GLU H A 73 ILE HA 1.0 . 5.29 2632 2632 A 72 GLU HA A 73 ILE H 1.0 . 2.76 2633 2633 A 72 GLU HA A 73 ILE HA 1.0 . 4.28 2634 2634 A 72 GLU HBy A 74 ILE H 1.0 . 5.94 2635 2635 A 13 PHE HZ A 73 ILE HD1% 1.0 . 3.71 2636 2636 A 13 PHE HZ A 73 ILE HG2% 1.0 . 0.00 2637 2637 A 13 PHE HZ A 40 LEU HD21 1.0 . 0.00 2638 2638 A 13 PHE HZ A 73 ILE HD1% 1.0 . 4.03 2639 2639 A 13 PHE HZ A 73 ILE HG2% 1.0 . 3.83 2640 2640 A 13 PHE HD% A 73 ILE HG2% 1.0 . 0.00 2641 2641 A 15 MET HE% A 73 ILE HD1% 1.0 . 3.55 2642 2642 A 15 MET HE% A 30 ILE HD1% 1.0 . 0.00 2643 2643 A 73 ILE HG2% A 62 ILE HG2% 1.0 . 3.55 2644 2644 A 73 ILE HG2% A 44 VAL HGx% 1.0 . 0.00 2645 2645 A 71 LEU HDx% A 73 ILE HD1% 1.0 . 3.99 2646 2646 A 73 ILE H A 72 GLU HGx 1.0 . 4.62 2647 2647 A 73 ILE H A 72 GLU HBx 1.0 . 0.00 2648 2648 A 73 ILE H A 72 GLU HGx 1.0 . 4.36 2649 2649 A 72 GLU HGx A 72 GLU H 1.0 . 0.00 2650 2650 A 72 GLU HGy A 73 ILE H 1.0 . 4.48 2651 2651 A 72 GLU HGy A 72 GLU H 1.0 . 0.00 2652 2652 A 73 ILE HG2% A 73 ILE H 1.0 . 3.61 2653 2653 A 73 ILE HD1% A 73 ILE H 1.0 . 0.00 2654 2654 A 73 ILE HG1x A 73 ILE H 1.0 . 4.30 2655 2655 A 73 ILE H A 64 VAL HGx% 1.0 . 0.00 2656 2656 A 73 ILE HD1% A 73 ILE HG1y 1.0 . 3.57 2657 2657 A 73 ILE HG2% A 73 ILE HG1y 1.0 . 0.00 2658 2658 A 40 LEU HD21 A 73 ILE HG1y 1.0 . 0.00 2659 2659 A 73 ILE HG2% A 73 ILE HA 1.0 . 4.05 2660 2660 A 73 ILE HD1% A 73 ILE HA 1.0 . 4.54 2661 2661 A 73 ILE HD1% A 73 ILE H 1.0 . 4.53 2662 2662 A 73 ILE HG2% A 73 ILE HG1x 1.0 . 3.43 2663 2663 A 73 ILE HD1% A 73 ILE HG1x 1.0 . 0.00 2664 2664 A 73 ILE HG1x A 73 ILE H 1.0 . 5.48 2665 2665 A 73 ILE HG2% A 73 ILE HA 1.0 . 4.03 2666 2666 A 73 ILE HD1% A 73 ILE HA 1.0 . 0.00 2667 2667 A 73 ILE HG1y A 73 ILE HA 1.0 . 4.78 2668 2668 A 73 ILE HG1x A 73 ILE HA 1.0 . 3.94 2669 2669 A 73 ILE H A 73 ILE HG1y 1.0 . 4.47 2670 2670 A 73 ILE HD1% A 73 ILE HG1y 1.0 . 3.36 2671 2671 A 73 ILE HG1y A 73 ILE HA 1.0 . 5.48 2672 2672 A 73 ILE HG2% A 73 ILE H 1.0 . 3.94 2673 2673 A 73 ILE HG2% A 73 ILE HG1x 1.0 . 2.62 2674 2674 A 74 ILE HA A 12 LYS HDx 1.0 . 6.37 2675 2675 A 62 ILE HG2% A 74 ILE H 1.0 . 5.94 2676 2676 A 74 ILE HD1% A 63 GLN HE2x 1.0 . 5.34 2677 2677 A 74 ILE HG2% A 63 GLN HGx 1.0 . 3.55 2678 2678 A 74 ILE HD1% A 63 GLN HGx 1.0 . 0.00 2679 2679 A 74 ILE HD1% A 63 GLN HE2x 1.0 . 5.66 2680 2680 A 74 ILE HB A 63 GLN HGy 1.0 . 4.14 2681 2681 A 74 ILE HB A 63 GLN HBy 1.0 . 0.00 2682 2682 A 73 ILE HG2% A 74 ILE H 1.0 . 4.15 2683 2683 A 73 ILE H A 74 ILE H 1.0 . 5.29 2684 2684 A 73 ILE HA A 74 ILE H 1.0 . 2.86 2685 2685 A 73 ILE HG2% A 74 ILE H 1.0 . 4.00 2686 2686 A 74 ILE HB A 73 ILE HA 1.0 . 4.77 2687 2687 A 73 ILE HA A 74 ILE H 1.0 . 4.13 2688 2688 A 74 ILE HA A 74 ILE H 1.0 . 5.29 2689 2689 A 74 ILE HB A 74 ILE H 1.0 . 3.10 2690 2690 A 74 ILE HG2% A 74 ILE H 1.0 . 4.26 2691 2691 A 74 ILE HD1% A 74 ILE H 1.0 . 0.00 2692 2692 A 74 ILE HA A 74 ILE HG1y 1.0 . 4.30 2693 2693 A 74 ILE H A 74 ILE HG1x 1.0 . 5.21 2694 2694 A 74 ILE HA A 74 ILE HG1x 1.0 . 3.78 2695 2695 A 74 ILE HD1% A 74 ILE H 1.0 . 4.34 2696 2696 A 74 ILE HD1% A 74 ILE HB 1.0 . 2.57 2697 2697 A 74 ILE HD1% A 74 ILE HG1x 1.0 . 2.60 2698 2698 A 74 ILE HG2% A 74 ILE HG1x 1.0 . 3.55 2699 2699 A 74 ILE HG2% A 74 ILE HA 1.0 . 3.24 2700 2700 A 74 ILE HA A 74 ILE HG1y 1.0 . 0.00 2701 2701 A 74 ILE HD1% A 74 ILE HA 1.0 . 0.00 2702 2702 A 74 ILE HA A 74 ILE HG1x 1.0 . 4.09 2703 2703 A 74 ILE HA A 74 ILE H 1.0 . 3.55 2704 2704 A 74 ILE HG2% A 74 ILE H 1.0 . 4.31 2705 2705 A 74 ILE HB A 74 ILE H 1.0 . 3.17 2706 2706 A 74 ILE HD1% A 74 ILE HB 1.0 . 3.07 2707 2707 A 74 ILE HG2% A 74 ILE HB 1.0 . 0.00 2708 2708 A 74 ILE HG1y A 74 ILE HB 1.0 . 0.00 2709 2709 A 74 ILE HG2% A 74 ILE HB 1.0 . 2.70 2710 2710 A 74 ILE HA A 74 ILE HB 1.0 . 4.37 2711 2711 A 74 ILE HG2% A 74 ILE HA 1.0 . 3.33 2712 2712 A 74 ILE HD1% A 74 ILE HA 1.0 . 3.58 2713 2713 A 75 VAL H A 74 ILE H 1.0 . 4.45 2714 2714 A 74 ILE HD1% A 75 VAL H 1.0 . 5.14 2715 2715 A 75 VAL H A 74 ILE HG1y 1.0 . 4.52 2716 2716 A 74 ILE HA A 75 VAL H 1.0 . 3.49 2717 2717 A 74 ILE HG2% A 75 VAL H 1.0 . 3.73 2718 2718 A 74 ILE HD1% A 75 VAL H 1.0 . 0.00 2719 2719 A 75 VAL H A 74 ILE HG1y 1.0 . 0.00 2720 2720 A 74 ILE HG2% A 75 VAL HA 1.0 . 3.99 2721 2721 A 74 ILE HG2% A 75 VAL H 1.0 . 3.44 2722 2722 A 75 VAL H A 75 VAL HGx% 1.0 . 4.54 2723 2723 A 75 VAL H A 75 VAL HB 1.0 . 4.10 2724 2724 A 75 VAL H A 75 VAL HA 1.0 . 3.21 2725 2725 A 75 VAL H A 75 VAL HA 1.0 . 2.82 2726 2726 A 75 VAL HGy% A 75 VAL HA 1.0 . 3.55 2727 2727 A 75 VAL HGy% A 75 VAL HA 1.0 . 3.14 2728 2728 A 75 VAL HGx% A 75 VAL HA 1.0 . 3.55 2729 2729 A 75 VAL HA A 75 VAL HB 1.0 . 3.22 2730 2730 A 75 VAL HGy% A 75 VAL HB 1.0 . 2.82 2731 2731 A 75 VAL HGx% A 75 VAL HA 1.0 . 3.55 2732 2732 A 76 THR HG2% A 61 TRP HE3 1.0 . 5.67 2733 2733 A 76 THR HG2% A 62 ILE HD1% 1.0 . 5.21 2734 2734 A 74 ILE HG2% A 76 THR HB 1.0 . 5.21 2735 2735 A 76 THR HG2% A 75 VAL HA 1.0 . 4.12 2736 2736 A 76 THR HB A 76 THR HA 1.0 . 5.02 2737 2737 A 76 THR HG2% A 76 THR HB 1.0 . 3.47 2738 2738 A 76 THR HG2% A 76 THR HB 1.0 . 3.63 2739 2739 A 76 THR HG2% A 76 THR HA 1.0 . 4.33 2740 2740 A 76 THR HG2% A 77 LYS H 1.0 . 5.07 2741 2741 A 76 THR HA A 77 LYS H 1.0 . 4.56 2742 2742 A 10 THR HA A 77 LYS H 1.0 . 0.00 2743 2743 A 76 THR HB A 77 LYS HA 1.0 . 5.21 2744 2744 A 76 THR HA A 77 LYS H 1.0 . 4.49 2745 2745 A 76 THR HG2% A 77 LYS H 1.0 . 4.36 2746 2746 A 77 LYS HBx A 77 LYS HA 1.0 . 4.16 2747 2747 A 77 LYS HGx A 77 LYS H 1.0 . 5.63 2748 2748 A 77 LYS HDy A 77 LYS HEy 1.0 . 3.59 2749 2749 A 77 LYS HGx A 77 LYS HEy 1.0 . 4.38 2750 2750 A 77 LYS HDy A 77 LYS HEx 1.0 . 3.68 2751 2751 A 77 LYS HGy A 77 LYS H 1.0 . 5.85 2752 2752 A 77 LYS HGy A 77 LYS HEx 1.0 . 3.67 2753 2753 A 77 LYS HGx A 77 LYS HEx 1.0 . 4.10 2754 2754 A 77 LYS HA A 77 LYS HBy 1.0 . 3.68 2755 2755 A 77 LYS HEy A 77 LYS HGy 1.0 . 3.80 2756 2756 A 77 LYS HDy A 77 LYS H 1.0 . 5.25 2757 2757 A 59 PRO HDy A 78 ALA HB% 1.0 . 4.45 2758 2758 A 59 PRO HGy A 78 ALA HB% 1.0 . 4.26 2759 2759 A 59 PRO HDy A 78 ALA HB% 1.0 . 4.42 2760 2760 A 59 PRO HGy A 78 ALA HA 1.0 . 5.21 2761 2761 A 59 PRO HGy A 58 GLY HAy 1.0 . 0.00 2762 2762 A 77 LYS HGx A 78 ALA H 1.0 . 4.56 2763 2763 A 77 LYS HBx A 78 ALA H 1.0 . 4.60 2764 2764 A 77 LYS HA A 78 ALA H 1.0 . 2.76 2765 2765 A 77 LYS HGy A 78 ALA H 1.0 . 4.48 2766 2766 A 77 LYS HBy A 78 ALA H 1.0 . 4.60 2767 2767 A 78 ALA HB% A 78 ALA H 1.0 . 3.10 2768 2768 A 78 ALA HA A 78 ALA H 1.0 . 3.10 2769 2769 A 78 ALA HB% A 78 ALA HA 1.0 . 2.72 2770 2770 A 78 ALA HB% A 78 ALA HA 1.0 . 2.72 2771 2771 A 78 ALA HB% A 78 ALA H 1.0 . 2.72 2772 2772 A 79 GLN HBy A 9 HIS HE1 1.0 . 4.05 2773 2773 A 8 GLU HBy A 9 HIS HE1 1.0 . 0.00 2774 2774 A 79 GLN HGy A 79 GLN HE2y 1.0 . 4.14 2775 2775 A 79 GLN HGy A 79 GLN HE2x 1.0 . 4.18 2776 2776 A 79 GLN HGy A 79 GLN HA 1.0 . 4.43 2777 2777 A 79 GLN HBy A 79 GLN HE2x 1.0 . 3.87 2778 2778 A 79 GLN HGy A 79 GLN HE2y 1.0 . 4.94 2779 2779 A 79 GLN HBy A 79 GLN HA 1.0 . 4.15 2780 2780 A 79 GLN HGy A 79 GLN HA 1.0 . 4.34 2781 2781 A 79 GLN HGy A 79 GLN HE2x 1.0 . 4.66 2782 2782 A 81 SER HBy A 81 SER HA 1.0 . 3.07 2783 2783 A 81 SER HBy A 81 SER HA 1.0 . 3.24 2784 2784 A 81 SER HA A 81 SER HBx 1.0 . 3.04 2785 2785 A 81 SER HA A 81 SER HBx 1.0 . 3.23 2786 2786 A 81 SER HA A 83 ASP H 1.0 . 4.15 2787 2787 A 83 ASP H A 82 LYS HA 1.0 . 0.00 2788 2788 A 81 SER HBx A 84 LEU HBy 1.0 . 4.18 2789 2789 A 81 SER HBy A 84 LEU HDx% 1.0 . 4.32 2790 2790 A 81 SER HBy A 84 LEU HBy 1.0 . 4.21 2791 2791 A 81 SER HBx A 84 LEU HDx% 1.0 . 4.21 2792 2792 A 83 ASP H A 82 LYS HBx 1.0 . 4.77 2793 2793 A 83 ASP H A 83 ASP HA 1.0 . 4.09 2794 2794 A 83 ASP H A 83 ASP HBy 1.0 . 4.76 2795 2795 A 83 ASP HA A 83 ASP HBx 1.0 . 3.18 2796 2796 A 83 ASP H A 83 ASP HBx 1.0 . 4.89 2797 2797 A 83 ASP H A 83 ASP HA 1.0 . 3.71 2798 2798 A 83 ASP HA A 83 ASP HBx 1.0 . 3.45 2799 2799 A 83 ASP HA A 83 ASP HBy 1.0 . 3.55 2800 2800 A 81 SER HA A 84 LEU HBy 1.0 . 3.92 2801 2801 A 81 SER HA A 84 LEU HDx% 1.0 . 4.20 2802 2802 A 83 ASP HA A 84 LEU H 1.0 . 4.02 2803 2803 A 83 ASP H A 84 LEU HA 1.0 . 3.91 2804 2804 A 84 LEU HA A 85 ASP H 1.0 . 0.00 2805 2805 A 84 LEU H A 84 LEU HA 1.0 . 4.42 2806 2806 A 84 LEU HBy A 84 LEU H 1.0 . 3.79 2807 2807 A 84 LEU H A 84 LEU HDy% 1.0 . 4.93 2808 2808 A 84 LEU H A 84 LEU HBx 1.0 . 3.78 2809 2809 A 84 LEU HBy A 84 LEU H 1.0 . 3.91 2810 2810 A 84 LEU HA A 84 LEU HDy% 1.0 . 3.99 2811 2811 A 84 LEU HDx% A 84 LEU HA 1.0 . 3.99 2812 2812 A 84 LEU HDy% A 84 LEU HG 1.0 . 3.55 2813 2813 A 84 LEU HBy A 84 LEU HDy% 1.0 . 3.17 2814 2814 A 84 LEU HBy A 84 LEU HDx% 1.0 . 3.17 2815 2815 A 84 LEU HDy% A 84 LEU HBx 1.0 . 3.55 2816 2816 A 84 LEU HBy A 84 LEU HA 1.0 . 3.18 2817 2817 A 84 LEU HBy A 84 LEU HA 1.0 . 3.55 2818 2818 A 84 LEU H A 84 LEU HBx 1.0 . 3.70 2819 2819 A 84 LEU HA A 84 LEU HBx 1.0 . 3.55 2820 2820 A 84 LEU HDy% A 84 LEU HG 1.0 . 2.72 2821 2821 A 84 LEU HA A 84 LEU HG 1.0 . 3.55 2822 2822 A 84 LEU HDx% A 84 LEU HBx 1.0 . 3.55 2823 2823 A 84 LEU HA A 84 LEU HG 1.0 . 3.58 2824 2824 A 84 LEU HDx% A 84 LEU HA 1.0 . 3.99 2825 2825 A 84 LEU HA A 84 LEU HDy% 1.0 . 3.99 2826 2826 A 84 LEU H A 84 LEU HG 1.0 . 5.21 2827 2827 A 84 LEU HA A 84 LEU HBx 1.0 . 3.31 2828 2828 A 84 LEU H A 84 LEU HA 1.0 . 4.09 2829 2829 A 85 ASP H A 84 LEU HBx 1.0 . 3.98 2830 2830 A 84 LEU HBy A 85 ASP H 1.0 . 3.99 2831 2831 A 84 LEU H A 85 ASP HBy 1.0 . 5.76 2832 2832 A 84 LEU HDx% A 85 ASP HA 1.0 . 5.21 2833 2833 A 85 ASP HA A 87 LEU HDy% 1.0 . 0.00 2834 2834 A 84 LEU H A 86 LYS H 1.0 . 2.99 2835 2835 A 84 LEU HA A 86 LYS H 1.0 . 4.95 2836 2836 A 85 ASP H A 84 LEU HDy% 1.0 . 4.87 2837 2837 A 84 LEU H A 85 ASP H 1.0 . 4.82 2838 2838 A 84 LEU HA A 85 ASP H 1.0 . 3.74 2839 2839 A 85 ASP H A 85 ASP HBy 1.0 . 3.52 2840 2840 A 85 ASP H A 85 ASP HA 1.0 . 3.77 2841 2841 A 85 ASP H A 85 ASP HA 1.0 . 3.90 2842 2842 A 85 ASP H A 85 ASP HBx 1.0 . 4.08 2843 2843 A 85 ASP HA A 85 ASP HBx 1.0 . 3.17 2844 2844 A 85 ASP H A 85 ASP HBy 1.0 . 4.16 2845 2845 A 85 ASP HA A 85 ASP HBx 1.0 . 3.55 2846 2846 A 85 ASP HBy A 85 ASP HA 1.0 . 3.55 2847 2847 A 85 ASP HBy A 85 ASP HA 1.0 . 3.10 2848 2848 A 85 ASP H A 86 LYS H 1.0 . 5.20 2849 2849 A 85 ASP H A 86 LYS H 1.0 . 5.39 2850 2850 A 85 ASP HBy A 86 LYS HA 1.0 . 5.85 2851 2851 A 85 ASP HBy A 86 LYS HA 1.0 . 5.85 2852 2852 A 85 ASP HBy A 86 LYS H 1.0 . 4.32 2853 2853 A 85 ASP HA A 86 LYS H 1.0 . 3.88 2854 2854 A 85 ASP HA A 86 LYS H 1.0 . 3.92 2855 2855 A 85 ASP HBy A 86 LYS H 1.0 . 4.51 2856 2856 A 86 LYS H A 86 LYS HBy 1.0 . 3.68 2857 2857 A 86 LYS H A 86 LYS HGy 1.0 . 4.39 2858 2858 A 86 LYS H A 86 LYS HDy 1.0 . 3.79 2859 2859 A 86 LYS H A 86 LYS HBx 1.0 . 3.89 2860 2860 A 86 LYS H A 86 LYS HA 1.0 . 4.07 2861 2861 A 86 LYS HA A 86 LYS HGy 1.0 . 3.55 2862 2862 A 86 LYS HA A 86 LYS HBx 1.0 . 3.17 2863 2863 A 86 LYS HDy A 86 LYS HEy 1.0 . 3.55 2864 2864 A 86 LYS HGy A 86 LYS HEy 1.0 . 3.73 2865 2865 A 86 LYS H A 86 LYS HGx 1.0 . 5.82 2866 2866 A 86 LYS HGy A 86 LYS HBx 1.0 . 3.06 2867 2867 A 86 LYS HEy A 86 LYS HGx 1.0 . 3.40 2868 2868 A 86 LYS HA A 86 LYS HBx 1.0 . 3.29 2869 2869 A 86 LYS HA A 86 LYS HEy 1.0 . 5.13 2870 2870 A 86 LYS HA A 86 LYS HGx 1.0 . 3.64 2871 2871 A 86 LYS HA A 86 LYS HDy 1.0 . 3.17 2872 2872 A 86 LYS HA A 86 LYS HGy 1.0 . 3.60 2873 2873 A 86 LYS H A 86 LYS HGy 1.0 . 4.77 2874 2874 A 86 LYS HBx A 86 LYS HEy 1.0 . 4.88 2875 2875 A 86 LYS HDy A 86 LYS HEy 1.0 . 5.85 2876 2876 A 86 LYS H A 86 LYS HBx 1.0 . 5.21 2877 2877 A 86 LYS HBy A 86 LYS HGy 1.0 . 2.76 2878 2878 A 86 LYS HA A 86 LYS HDy 1.0 . 3.88 2879 2879 A 86 LYS HGy A 86 LYS HEy 1.0 . 3.55 2880 2880 A 86 LYS HBy A 86 LYS HEy 1.0 . 4.65 2881 2881 A 86 LYS HA A 86 LYS HBy 1.0 . 3.25 2882 2882 A 86 LYS HA A 86 LYS HBy 1.0 . 3.55 2883 2883 A 86 LYS H A 86 LYS HBy 1.0 . 5.18 2884 2884 A 86 LYS H A 86 LYS HA 1.0 . 3.94 2885 2885 A 86 LYS HA A 87 LEU H 1.0 . 3.60 2886 2886 A 86 LYS HA A 87 LEU H 1.0 . 3.50 2887 2887 A 86 LYS HA A 87 LEU HDx% 1.0 . 5.21 2888 2888 A 87 LEU HDy% A 86 LYS HA 1.0 . 5.21 2889 2889 A 87 LEU H A 87 LEU HDx% 1.0 . 4.65 2890 2890 A 87 LEU H A 87 LEU HBx 1.0 . 3.42 2891 2891 A 87 LEU H A 87 LEU HG 1.0 . 0.00 2892 2892 A 87 LEU H A 87 LEU HBy 1.0 . 3.41 2893 2893 A 87 LEU HBy A 87 LEU HA 1.0 . 3.55 2894 2894 A 87 LEU H A 87 LEU HA 1.0 . 3.18 2895 2895 A 87 LEU HDx% A 87 LEU HA 1.0 . 3.55 2896 2896 A 87 LEU HBy A 87 LEU HA 1.0 . 3.44 2897 2897 A 87 LEU HDy% A 87 LEU HBx 1.0 . 3.17 2898 2898 A 87 LEU HDy% A 87 LEU HA 1.0 . 3.58 2899 2899 A 87 LEU HDx% A 87 LEU HA 1.0 . 3.55 2900 2900 A 87 LEU HBx A 87 LEU HA 1.0 . 3.07 2901 2901 A 87 LEU HDx% A 87 LEU HBy 1.0 . 3.55 2902 2902 A 87 LEU HG A 87 LEU HA 1.0 . 2.96 2903 2903 A 87 LEU HBx A 87 LEU HA 1.0 . 0.00 2904 2904 A 87 LEU H A 87 LEU HBy 1.0 . 3.68 2905 2905 A 87 LEU HDx% A 87 LEU HG 1.0 . 3.55 2906 2906 A 87 LEU HDy% A 87 LEU HBx 1.0 . 2.36 2907 2907 A 87 LEU HDy% A 87 LEU HG 1.0 . 0.00 2908 2908 A 87 LEU HDx% A 87 LEU HBx 1.0 . 3.17 2909 2909 A 87 LEU HDy% A 87 LEU HBy 1.0 . 3.17 2910 2910 A 87 LEU HDy% A 87 LEU HBy 1.0 . 3.55 2911 2911 A 87 LEU H A 87 LEU HBx 1.0 . 3.84 2912 2912 A 87 LEU HDy% A 87 LEU HA 1.0 . 3.55 2913 2913 A 87 LEU HG A 87 LEU HA 1.0 . 3.88 2914 2914 A 87 LEU HBx A 88 VAL H 1.0 . 4.11 2915 2915 A 87 LEU HA A 88 VAL H 1.0 . 3.36 2916 2916 A 87 LEU HA A 88 VAL HGx% 1.0 . 5.85 2917 2917 A 87 LEU HA A 88 VAL H 1.0 . 3.19 2918 2918 A 87 LEU HA A 88 VAL HGy% 1.0 . 3.99 2919 2919 A 88 VAL H A 88 VAL HB 1.0 . 4.09 2920 2920 A 88 VAL H A 89 PRO HGy 1.0 . 0.00 2921 2921 A 88 VAL H A 88 VAL HGy% 1.0 . 3.83 2922 2922 A 88 VAL H A 88 VAL HGy% 1.0 . 3.42 2923 2923 A 88 VAL HGy% A 88 VAL HA 1.0 . 3.55 2924 2924 A 88 VAL H A 88 VAL HB 1.0 . 3.89 2925 2925 A 88 VAL HGy% A 88 VAL HB 1.0 . 2.73 2926 2926 A 88 VAL H A 88 VAL HA 1.0 . 3.91 2927 2927 A 88 VAL HB A 88 VAL HA 1.0 . 3.41 2928 2928 A 88 VAL HB A 89 PRO HA 1.0 . 0.00 2929 2929 A 88 VAL HGy% A 88 VAL HA 1.0 . 3.20 2930 2930 A 88 VAL HGy% A 89 PRO HA 1.0 . 0.00 2931 2931 A 88 VAL HB A 88 VAL HA 1.0 . 3.34 2932 2932 A 89 PRO HGy A 88 VAL HA 1.0 . 0.00 2933 2933 A 88 VAL H A 89 PRO HA 1.0 . 3.36 2934 2934 A 88 VAL H A 88 VAL HA 1.0 . 0.00 2935 2935 A 88 VAL HA A 89 PRO HDy 1.0 . 2.86 2936 2936 A 88 VAL HA A 89 PRO HDx 1.0 . 2.78 2937 2937 A 88 VAL HA A 89 PRO HDy 1.0 . 2.92 2938 2938 A 88 VAL HGx% A 89 PRO HDy 1.0 . 4.65 2939 2939 A 88 VAL HA A 89 PRO HDx 1.0 . 2.85 2940 2940 A 88 VAL HGx% A 89 PRO HGy 1.0 . 2.82 2941 2941 A 88 VAL HGx% A 88 VAL HB 1.0 . 0.00 2942 2942 A 88 VAL HB A 89 PRO HDy 1.0 . 3.79 2943 2943 A 88 VAL H A 89 PRO HA 1.0 . 2.81 2944 2944 A 89 PRO HA A 90 ARG H 1.0 . 0.00 2945 2945 A 88 VAL HGx% A 89 PRO HDy 1.0 . 4.34 2946 2946 A 88 VAL HGx% A 89 PRO HDx 1.0 . 5.21 2947 2947 A 88 VAL HGx% A 89 PRO HA 1.0 . 3.14 2948 2948 A 88 VAL HGx% A 88 VAL HA 1.0 . 0.00 2949 2949 A 88 VAL HGy% A 89 PRO HGy 1.0 . 2.77 2950 2950 A 88 VAL HGy% A 88 VAL HB 1.0 . 0.00 2951 2951 A 88 VAL HGy% A 89 PRO HDy 1.0 . 4.15 2952 2952 A 88 VAL HB A 89 PRO HDx 1.0 . 4.82 2953 2953 A 88 VAL H A 89 PRO HGy 1.0 . 5.03 2954 2954 A 89 PRO HGy A 90 ARG H 1.0 . 0.00 2955 2955 A 89 PRO HDx A 89 PRO HBx 1.0 . 4.02 2956 2956 A 89 PRO HDx A 89 PRO HGx 1.0 . 3.55 2957 2957 A 89 PRO HA A 89 PRO HBx 1.0 . 3.24 2958 2958 A 89 PRO HA A 89 PRO HBy 1.0 . 3.48 2959 2959 A 89 PRO HA A 89 PRO HBy 1.0 . 3.23 2960 2960 A 89 PRO HA A 89 PRO HGx 1.0 . 0.00 2961 2961 A 89 PRO HGy A 89 PRO HBx 1.0 . 3.21 2962 2962 A 89 PRO HA A 89 PRO HBx 1.0 . 3.26 2963 2963 A 89 PRO HDx A 89 PRO HBy 1.0 . 4.04 2964 2964 A 89 PRO HA A 89 PRO HGx 1.0 . 4.34 2965 2965 A 89 PRO HGy A 89 PRO HDy 1.0 . 3.37 2966 2966 A 89 PRO HBx A 89 PRO HGx 1.0 . 2.93 2967 2967 A 89 PRO HDy A 89 PRO HGx 1.0 . 3.41 2968 2968 A 89 PRO HA A 89 PRO HDy 1.0 . 4.34 2969 2969 A 89 PRO HDy A 89 PRO HBy 1.0 . 2.85 2970 2970 A 89 PRO HDy A 89 PRO HGx 1.0 . 0.00 2971 2971 A 89 PRO HDx A 89 PRO HBx 1.0 . 4.17 2972 2972 A 89 PRO HDx A 89 PRO HGx 1.0 . 2.96 2973 2973 A 89 PRO HDx A 89 PRO HBy 1.0 . 0.00 2974 2974 A 89 PRO HDy A 89 PRO HBy 1.0 . 3.99 2975 2975 A 89 PRO HA A 89 PRO HDx 1.0 . 4.34 2976 2976 A 89 PRO HDy A 89 PRO HBx 1.0 . 4.32 2977 2977 A 89 PRO HGy A 89 PRO HA 1.0 . 4.34 2978 2978 A 89 PRO HDy A 89 PRO HBx 1.0 . 3.94 2979 2979 A 89 PRO HGy A 89 PRO HDx 1.0 . 3.66 2980 2980 A 89 PRO HGy A 89 PRO HDx 1.0 . 2.97 2981 2981 A 89 PRO HGy A 89 PRO HDy 1.0 . 2.86 2982 2982 A 90 ARG H A 89 PRO HBy 1.0 . 3.93 2983 2983 A 90 ARG H A 89 PRO HGx 1.0 . 0.00 2984 2984 A 90 ARG H A 89 PRO HBx 1.0 . 4.45 2985 2985 A 90 ARG H A 89 PRO HGx 1.0 . 5.27 2986 2986 A 90 ARG H A 89 PRO HBy 1.0 . 4.54 2987 2987 A 90 ARG H A 89 PRO HBx 1.0 . 4.43 2988 2988 A 88 VAL HA A 90 ARG H 1.0 . 3.37 2989 2989 A 89 PRO HA A 90 ARG H 1.0 . 0.00 2990 2990 A 88 VAL HGy% A 90 ARG H 1.0 . 5.36 2991 2991 A 90 ARG H A 90 ARG HBx 1.0 . 3.80 2992 2992 A 90 ARG H A 90 ARG HGy 1.0 . 3.58 2993 2993 A 90 ARG H A 90 ARG HDy 1.0 . 5.39 2994 2994 A 90 ARG H A 90 ARG HA 1.0 . 3.81 2995 2995 A 90 ARG H A 90 ARG HBy 1.0 . 3.60 2996 2996 A 90 ARG HGy A 90 ARG HA 1.0 . 3.55 2997 2997 A 90 ARG HGy A 90 ARG HDy 1.0 . 3.43 2998 2998 A 90 ARG HA A 90 ARG HBy 1.0 . 3.55 2999 2999 A 90 ARG HDy A 90 ARG HBy 1.0 . 4.90 3000 3000 A 90 ARG HGy A 90 ARG HA 1.0 . 3.54 3001 3001 A 90 ARG H A 90 ARG HGy 1.0 . 4.65 3002 3002 A 90 ARG HGy A 90 ARG HDy 1.0 . 3.55 3003 3003 A 90 ARG H A 90 ARG HBx 1.0 . 3.89 3004 3004 A 90 ARG HBx A 90 ARG HA 1.0 . 3.55 3005 3005 A 90 ARG HDy A 90 ARG HA 1.0 . 4.12 3006 3006 A 90 ARG HBx A 90 ARG HA 1.0 . 3.66 3007 3007 A 90 ARG HBx A 90 ARG HDy 1.0 . 4.42 3008 3008 A 90 ARG H A 90 ARG HBy 1.0 . 3.53 3009 3009 A 90 ARG HA A 90 ARG HBy 1.0 . 4.12 3010 3010 A 90 ARG H A 90 ARG HA 1.0 . 3.53 3011 3011 A 90 ARG HDy A 90 ARG HA 1.0 . 6.02 stop_ save_ save_DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 2 GLU C A 3 ILE N A 3 ILE CA A 3 ILE C 1.0 -150.0 -90.0 PHI 2 2 A 3 ILE N A 3 ILE CA A 3 ILE C A 4 GLU N 1.0 110.0 160.0 PSI 3 3 A 3 ILE C A 4 GLU N A 4 GLU CA A 4 GLU C 1.0 -150.0 -90.0 PHI 4 4 A 4 GLU N A 4 GLU CA A 4 GLU C A 5 ARG N 1.0 100.0 160.0 PSI 5 5 A 4 GLU C A 5 ARG N A 5 ARG CA A 5 ARG C 1.0 -130.0 -50.0 PHI 6 6 A 5 ARG N A 5 ARG CA A 5 ARG C A 6 ILE N 1.0 90.0 160.0 PSI 7 7 A 6 ILE C A 7 ASN N A 7 ASN CA A 7 ASN C 1.0 -130.0 -50.0 PHI 8 8 A 8 GLU N A 8 GLU CA A 8 GLU C A 9 HIS N 1.0 -50.0 10.0 PSI 9 9 A 9 HIS C A 10 THR N A 10 THR CA A 10 THR C 1.0 -160.0 -60.0 PHI 10 10 A 10 THR N A 10 THR CA A 10 THR C A 11 VAL N 1.0 100.0 170.0 PSI 11 11 A 10 THR C A 11 VAL N A 11 VAL CA A 11 VAL C 1.0 -170.0 -90.0 PHI 12 12 A 11 VAL N A 11 VAL CA A 11 VAL C A 12 LYS N 1.0 120.0 180.0 PSI 13 13 A 11 VAL C A 12 LYS N A 12 LYS CA A 12 LYS C 1.0 -150.0 -90.0 PHI 14 14 A 12 LYS N A 12 LYS CA A 12 LYS C A 13 PHE N 1.0 100.0 170.0 PSI 15 15 A 12 LYS C A 13 PHE N A 13 PHE CA A 13 PHE C 1.0 -150.0 -90.0 PHI 16 16 A 13 PHE N A 13 PHE CA A 13 PHE C A 14 TYR N 1.0 100.0 160.0 PSI 17 17 A 13 PHE C A 14 TYR N A 14 TYR CA A 14 TYR C 1.0 -150.0 -90.0 PHI 18 18 A 14 TYR N A 14 TYR CA A 14 TYR C A 15 MET N 1.0 110.0 170.0 PSI 19 19 A 14 TYR C A 15 MET N A 15 MET CA A 15 MET C 1.0 -160.0 -90.0 PHI 20 20 A 15 MET N A 15 MET CA A 15 MET C A 16 SER N 1.0 100.0 170.0 PSI 21 21 A 15 MET C A 16 SER N A 16 SER CA A 16 SER C 1.0 -120.0 -50.0 PHI 22 22 A 16 SER N A 16 SER CA A 16 SER C A 17 TYR N 1.0 120.0 180.0 PSI 23 23 A 16 SER C A 17 TYR N A 17 TYR CA A 17 TYR C 1.0 -80.0 -40.0 PHI 24 24 A 17 TYR N A 17 TYR CA A 17 TYR C A 18 GLY N 1.0 -60.0 -10.0 PSI 25 25 A 17 TYR C A 18 GLY N A 18 GLY CA A 18 GLY C 1.0 -90.0 -40.0 PHI 26 26 A 18 GLY N A 18 GLY CA A 18 GLY C A 19 ASP N 1.0 -70.0 -20.0 PSI 27 27 A 18 GLY C A 19 ASP N A 19 ASP CA A 19 ASP C 1.0 -90.0 -40.0 PHI 28 28 A 19 ASP N A 19 ASP CA A 19 ASP C A 20 ILE N 1.0 -70.0 -20.0 PSI 29 29 A 19 ASP C A 20 ILE N A 20 ILE CA A 20 ILE C 1.0 -90.0 -40.0 PHI 30 30 A 20 ILE N A 20 ILE CA A 20 ILE C A 21 GLU N 1.0 -70.0 -20.0 PSI 31 31 A 20 ILE C A 21 GLU N A 21 GLU CA A 21 GLU C 1.0 -90.0 -40.0 PHI 32 32 A 21 GLU N A 21 GLU CA A 21 GLU C A 22 ASP N 1.0 -70.0 -20.0 PSI 33 33 A 21 GLU C A 22 ASP N A 22 ASP CA A 22 ASP C 1.0 -80.0 -40.0 PHI 34 34 A 22 ASP N A 22 ASP CA A 22 ASP C A 23 ARG N 1.0 -50.0 0.0 PSI 35 35 A 22 ASP C A 23 ARG N A 23 ARG CA A 23 ARG C 1.0 -120.0 -60.0 PHI 36 36 A 23 ARG N A 23 ARG CA A 23 ARG C A 24 GLY N 1.0 -30.0 30.0 PSI 37 37 A 23 ARG C A 24 GLY N A 24 GLY CA A 24 GLY C 1.0 40.0 100.0 PHI 38 38 A 24 GLY N A 24 GLY CA A 24 GLY C A 25 PHE N 1.0 0.0 60.0 PSI 39 39 A 24 GLY C A 25 PHE N A 25 PHE CA A 25 PHE C 1.0 -160.0 -40.0 PHI 40 40 A 25 PHE N A 25 PHE CA A 25 PHE C A 26 ASP N 1.0 100.0 180.0 PSI 41 41 A 25 PHE C A 26 ASP N A 26 ASP CA A 26 ASP C 1.0 -110.0 -40.0 PHI 42 42 A 26 ASP N A 26 ASP CA A 26 ASP C A 27 ARG N 1.0 100.0 180.0 PSI 43 43 A 26 ASP C A 27 ARG N A 27 ARG CA A 27 ARG C 1.0 -80.0 -40.0 PHI 44 44 A 27 ARG N A 27 ARG CA A 27 ARG C A 28 GLU N 1.0 -60.0 -10.0 PSI 45 45 A 27 ARG C A 28 GLU N A 28 GLU CA A 28 GLU C 1.0 -90.0 -40.0 PHI 46 46 A 28 GLU N A 28 GLU CA A 28 GLU C A 29 GLU N 1.0 -70.0 -10.0 PSI 47 47 A 28 GLU C A 29 GLU N A 29 GLU CA A 29 GLU C 1.0 -90.0 -40.0 PHI 48 48 A 29 GLU N A 29 GLU CA A 29 GLU C A 30 ILE N 1.0 -70.0 -20.0 PSI 49 49 A 29 GLU C A 30 ILE N A 30 ILE CA A 30 ILE C 1.0 -90.0 -40.0 PHI 50 50 A 30 ILE N A 30 ILE CA A 30 ILE C A 31 TRP N 1.0 -70.0 -10.0 PSI 51 51 A 30 ILE C A 31 TRP N A 31 TRP CA A 31 TRP C 1.0 -90.0 -40.0 PHI 52 52 A 31 TRP N A 31 TRP CA A 31 TRP C A 32 TYR N 1.0 -60.0 -10.0 PSI 53 53 A 31 TRP C A 32 TYR N A 32 TYR CA A 32 TYR C 1.0 -120.0 -50.0 PHI 54 54 A 32 TYR N A 32 TYR CA A 32 TYR C A 33 ASN N 1.0 -60.0 20.0 PSI 55 55 A 33 ASN C A 34 ARG N A 34 ARG CA A 34 ARG C 1.0 -80.0 -40.0 PHI 56 56 A 34 ARG N A 34 ARG CA A 34 ARG C A 35 GLU N 1.0 -60.0 -10.0 PSI 57 57 A 34 ARG C A 35 GLU N A 35 GLU CA A 35 GLU C 1.0 -90.0 -40.0 PHI 58 58 A 35 GLU N A 35 GLU CA A 35 GLU C A 36 ARG N 1.0 -70.0 -20.0 PSI 59 59 A 35 GLU C A 36 ARG N A 36 ARG CA A 36 ARG C 1.0 -90.0 -40.0 PHI 60 60 A 36 ARG N A 36 ARG CA A 36 ARG C A 37 SER N 1.0 -60.0 -20.0 PSI 61 61 A 36 ARG C A 37 SER N A 37 SER CA A 37 SER C 1.0 -90.0 -40.0 PHI 62 62 A 37 SER N A 37 SER CA A 37 SER C A 38 GLU N 1.0 -70.0 -20.0 PSI 63 63 A 37 SER C A 38 GLU N A 38 GLU CA A 38 GLU C 1.0 -90.0 -40.0 PHI 64 64 A 38 GLU N A 38 GLU CA A 38 GLU C A 39 GLU N 1.0 -70.0 -20.0 PSI 65 65 A 38 GLU C A 39 GLU N A 39 GLU CA A 39 GLU C 1.0 -90.0 -40.0 PHI 66 66 A 39 GLU N A 39 GLU CA A 39 GLU C A 40 LEU N 1.0 -70.0 -20.0 PSI 67 67 A 39 GLU C A 40 LEU N A 40 LEU CA A 40 LEU C 1.0 -90.0 -40.0 PHI 68 68 A 40 LEU N A 40 LEU CA A 40 LEU C A 41 PHE N 1.0 -70.0 -20.0 PSI 69 69 A 40 LEU C A 41 PHE N A 41 PHE CA A 41 PHE C 1.0 -90.0 -40.0 PHI 70 70 A 41 PHE N A 41 PHE CA A 41 PHE C A 42 TRP N 1.0 -70.0 -20.0 PSI 71 71 A 41 PHE C A 42 TRP N A 42 TRP CA A 42 TRP C 1.0 -90.0 -40.0 PHI 72 72 A 42 TRP N A 42 TRP CA A 42 TRP C A 43 GLU N 1.0 -60.0 -10.0 PSI 73 73 A 42 TRP C A 43 GLU N A 43 GLU CA A 43 GLU C 1.0 -90.0 -40.0 PHI 74 74 A 43 GLU N A 43 GLU CA A 43 GLU C A 44 VAL N 1.0 -70.0 -10.0 PSI 75 75 A 43 GLU C A 44 VAL N A 44 VAL CA A 44 VAL C 1.0 -90.0 -40.0 PHI 76 76 A 44 VAL N A 44 VAL CA A 44 VAL C A 45 MET N 1.0 -70.0 -10.0 PSI 77 77 A 44 VAL C A 45 MET N A 45 MET CA A 45 MET C 1.0 -90.0 -40.0 PHI 78 78 A 45 MET N A 45 MET CA A 45 MET C A 46 ASP N 1.0 -70.0 -20.0 PSI 79 79 A 45 MET C A 46 ASP N A 46 ASP CA A 46 ASP C 1.0 -90.0 -40.0 PHI 80 80 A 46 ASP N A 46 ASP CA A 46 ASP C A 47 GLU N 1.0 -70.0 -20.0 PSI 81 81 A 46 ASP C A 47 GLU N A 47 GLU CA A 47 GLU C 1.0 -90.0 -40.0 PHI 82 82 A 47 GLU N A 47 GLU CA A 47 GLU C A 48 VAL N 1.0 -70.0 -20.0 PSI 83 83 A 47 GLU C A 48 VAL N A 48 VAL CA A 48 VAL C 1.0 -110.0 -40.0 PHI 84 84 A 48 VAL N A 48 VAL CA A 48 VAL C A 49 HIS N 1.0 -70.0 10.0 PSI 85 85 A 48 VAL C A 49 HIS N A 49 HIS CA A 49 HIS C 1.0 -100.0 -40.0 PHI 86 86 A 49 HIS N A 49 HIS CA A 49 HIS C A 50 GLU N 1.0 -70.0 10.0 PSI 87 87 A 49 HIS C A 50 GLU N A 50 GLU CA A 50 GLU C 1.0 -100.0 -30.0 PHI 88 88 A 50 GLU N A 50 GLU CA A 50 GLU C A 51 GLU N 1.0 -70.0 10.0 PSI 89 89 A 50 GLU C A 51 GLU N A 51 GLU CA A 51 GLU C 1.0 -90.0 -40.0 PHI 90 90 A 51 GLU N A 51 GLU CA A 51 GLU C A 52 GLU N 1.0 -70.0 0.0 PSI 91 91 A 51 GLU C A 52 GLU N A 52 GLU CA A 52 GLU C 1.0 -100.0 -30.0 PHI 92 92 A 52 GLU N A 52 GLU CA A 52 GLU C A 53 GLU N 1.0 -70.0 10.0 PSI 93 93 A 52 GLU C A 53 GLU N A 53 GLU CA A 53 GLU C 1.0 -100.0 -30.0 PHI 94 94 A 53 GLU N A 53 GLU CA A 53 GLU C A 54 PHE N 1.0 -70.0 10.0 PSI 95 95 A 53 GLU C A 54 PHE N A 54 PHE CA A 54 PHE C 1.0 -110.0 -40.0 PHI 96 96 A 54 PHE N A 54 PHE CA A 54 PHE C A 55 ALA N 1.0 -70.0 10.0 PSI 97 97 A 55 ALA C A 56 VAL N A 56 VAL CA A 56 VAL C 1.0 -160.0 -50.0 PHI 98 98 A 56 VAL N A 56 VAL CA A 56 VAL C A 57 GLU N 1.0 90.0 170.0 PSI 99 99 A 59 PRO N A 59 PRO CA A 59 PRO C A 60 LEU N 1.0 120.0 170.0 PSI 100 100 A 59 PRO C A 60 LEU N A 60 LEU CA A 60 LEU C 1.0 -170.0 -50.0 PHI 101 101 A 60 LEU N A 60 LEU CA A 60 LEU C A 61 TRP N 1.0 100.0 180.0 PSI 102 102 A 60 LEU C A 61 TRP N A 61 TRP CA A 61 TRP C 1.0 -150.0 -90.0 PHI 103 103 A 61 TRP N A 61 TRP CA A 61 TRP C A 62 ILE N 1.0 100.0 170.0 PSI 104 104 A 61 TRP C A 62 ILE N A 62 ILE CA A 62 ILE C 1.0 -150.0 -80.0 PHI 105 105 A 62 ILE N A 62 ILE CA A 62 ILE C A 63 GLN N 1.0 100.0 160.0 PSI 106 106 A 62 ILE C A 63 GLN N A 63 GLN CA A 63 GLN C 1.0 -140.0 -80.0 PHI 107 107 A 63 GLN N A 63 GLN CA A 63 GLN C A 64 VAL N 1.0 100.0 160.0 PSI 108 108 A 63 GLN C A 64 VAL N A 64 VAL CA A 64 VAL C 1.0 -150.0 -90.0 PHI 109 109 A 64 VAL N A 64 VAL CA A 64 VAL C A 65 GLN N 1.0 100.0 160.0 PSI 110 110 A 64 VAL C A 65 GLN N A 65 GLN CA A 65 GLN C 1.0 -150.0 -90.0 PHI 111 111 A 65 GLN N A 65 GLN CA A 65 GLN C A 66 ALA N 1.0 110.0 170.0 PSI 112 112 A 65 GLN C A 66 ALA N A 66 ALA CA A 66 ALA C 1.0 -130.0 -40.0 PHI 113 113 A 66 ALA N A 66 ALA CA A 66 ALA C A 67 LEU N 1.0 100.0 170.0 PSI 114 114 A 66 ALA C A 67 LEU N A 67 LEU CA A 67 LEU C 1.0 -180.0 -90.0 PHI 115 115 A 67 LEU N A 67 LEU CA A 67 LEU C A 68 ASP N 1.0 120.0 190.0 PSI 116 116 A 67 LEU C A 68 ASP N A 68 ASP CA A 68 ASP C 1.0 -90.0 -40.0 PHI 117 117 A 68 ASP N A 68 ASP CA A 68 ASP C A 69 LYS N 1.0 -60.0 0.0 PSI 118 118 A 70 GLY C A 71 LEU N A 71 LEU CA A 71 LEU C 1.0 -170.0 -110.0 PHI 119 119 A 71 LEU N A 71 LEU CA A 71 LEU C A 72 GLU N 1.0 130.0 180.0 PSI 120 120 A 71 LEU C A 72 GLU N A 72 GLU CA A 72 GLU C 1.0 -160.0 -90.0 PHI 121 121 A 72 GLU N A 72 GLU CA A 72 GLU C A 73 ILE N 1.0 100.0 160.0 PSI 122 122 A 72 GLU C A 73 ILE N A 73 ILE CA A 73 ILE C 1.0 -150.0 -90.0 PHI 123 123 A 73 ILE N A 73 ILE CA A 73 ILE C A 74 ILE N 1.0 100.0 150.0 PSI 124 124 A 73 ILE C A 74 ILE N A 74 ILE CA A 74 ILE C 1.0 -150.0 -80.0 PHI 125 125 A 74 ILE N A 74 ILE CA A 74 ILE C A 75 VAL N 1.0 100.0 150.0 PSI 126 126 A 74 ILE C A 75 VAL N A 75 VAL CA A 75 VAL C 1.0 -150.0 -80.0 PHI 127 127 A 75 VAL N A 75 VAL CA A 75 VAL C A 76 THR N 1.0 100.0 150.0 PSI 128 128 A 75 VAL C A 76 THR N A 76 THR CA A 76 THR C 1.0 -150.0 -80.0 PHI 129 129 A 76 THR N A 76 THR CA A 76 THR C A 77 LYS N 1.0 100.0 160.0 PSI 130 130 A 76 THR C A 77 LYS N A 77 LYS CA A 77 LYS C 1.0 -150.0 -50.0 PHI 131 131 A 77 LYS N A 77 LYS CA A 77 LYS C A 78 ALA N 1.0 90.0 170.0 PSI stop_ save_